ethyl 2-[6-[4-[4-[[(Z)-1-[[(2S)-2-acetyloxypropyl]amino]-1-oxidanylidene-but-2-en-2-yl]carbamoyl]-1,3-thiazol-2-yl]-1,3-thiazol-2-yl]-2-[2-[(1S,2R)-2-[tert-butyl(diphenyl)silyl]oxy-1-[[2-[(1R)-2-methyl-1-[(2-methylpropan-2-yl)oxycarbonylamino]-2-oxidanyl-propyl]-1,3-thiazol-4-yl]carbonylamino]propyl]-1,3-thiazol-4-yl]pyridin-3-yl]-1,3-thiazole-4-carboxylate

Systemtic Name: ethyl 2-[6-[4-[4-[[(Z)-1-[[(2S)-2-acetyloxypropyl]amino]-1-oxidanylidene-but-2-en-2-yl]carbamoyl]-1,3-thiazol-2-yl]-1,3-thiazol-2-yl]-2-[2-[(1S,2R)-2-[tert-butyl(diphenyl)silyl]oxy-1-[[2-[(1R)-2-methyl-1-[(2-methylpropan-2-yl)oxycarbonylamino]-2-oxidanyl-propyl]-1,3-thiazol-4-yl]carbonylamino]propyl]-1,3-thiazol-4-yl]pyridin-3-yl]-1,3-thiazole-4-carboxylate Openeye Name: ethyl 2-[6-[4-[4-[[(Z)-1-[[(2S)-2-acetoxypropyl]carbamoyl]prop-1-enyl]carbamoyl]thiazol-2-yl]thiazol-2-yl]-2-[2-[(1S,2R)-1-[[2-[(1R)-1-(tert-butoxycarbonylamino)-2-hydroxy-2-methyl-propyl]thiazole-4-carbonyl]amino]-2-[tert-butyl(diphenyl)silyl]oxy-propyl]thiazol-4-yl]-3-pyridyl]thiazole-4-carboxylate CAS Name: 2-[6-[4-[4-[[[(Z)-1-[[(2S)-2-acetyloxypropyl]amino]-1-oxobut-2-en-2-yl]amino]-oxomethyl]-2-thiazolyl]-2-thiazolyl]-2-[2-[(1S,2R)-2-[tert-butyl(diphenyl)silyl]oxy-1-[[[2-[(1R)-2-hydroxy-2-methyl-1-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]propyl]-4-thiazolyl]-oxomethyl]amino]propyl]-4-thiazolyl]-3-pyridinyl]-4-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[6-[4-[4-[[(Z)-1-[[(2S)-2-acetyloxypropyl]amino]-1-oxobut-2-en-2-yl]carbamoyl]-1,3-thiazol-2-yl]-1,3-thiazol-2-yl]-2-[2-[(1S,2R)-2-[tert-butyl(diphenyl)silyl]oxy-1-[[2-[(1R)-2-hydroxy-2-methyl-1-[(2-methylpropan-2-yl)oxycarbonylamino]propyl]-1,3-thiazole-4-carbonyl]amino]propyl]-1,3-thiazol-4-yl]pyridin-3-yl]-1,3-thiazole-4-carboxylate Traditional Name: 2-[6-[4-[4-[[(Z)-1-[[(2S)-2-acetoxypropyl]carbamoyl]prop-1-enyl]carbamoyl]thiazol-2-yl]thiazol-2-yl]-2-[2-[(1S,2R)-1-[[2-[(1R)-1-(tert-butoxycarbonylamino)-2-hydroxy-2-methyl-propyl]thiazole-4-carbonyl]amino]-2-[tert-butyl(diphenyl)silyl]oxy-propyl]thiazol-4-yl]-3-pyridyl]thiazole-4-carboxylic acid ethyl ester Formula: C62H70N10O11S5Si MolecularWeight: 1319.6901

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CSC(=N1)C2=C(N=C(C=C2)C3=NC(=CS3)C4=NC(=CS4)C(=O)NC(=CC)C(=O)NCC(C)OC(=O)C)C5=CSC(=N5)C(C(C)O[Si](C6=CC=CC=C6)(C7=CC=CC=C7)C(C)(C)C)NC(=O)C8=CSC(=N8)C(C(C)(C)O)NC(=O)OC(C)(C)C

Isomeric SMILES

CCOC(=O)C1=CSC(=N1)C2=C(N=C(C=C2)C3=NC(=CS3)C4=NC(=CS4)C(=O)N/C(=C\C)/C(=O)NC[C@H](C)OC(=O)C)C5=CSC(=N5)[C@H]([C@@H](C)O[Si](C6=CC=CC=C6)(C7=CC=CC=C7)C(C)(C)C)NC(=O)C8=CSC(=N8)[C@@H](C(C)(C)O)NC(=O)OC(C)(C)C

InChI

InChI=1S/C62H70N10O11S5Si/c1-14-40(50(74)63-28-34(3)81-36(5)73)65-51(75)43-30-85-55(67-43)45-32-86-54(69-45)41-27-26-39(53-70-46(33-84-53)58(77)80-15-2)48(64-41)42-29-87-56(66-42)47(35(4)83-89(61(9,10)11,37-22-18-16-19-23-37)38-24-20-17-21-25-38)71-52(76)44-31-88-57(68-44)49(62(12,13)79)72-59(78)82-60(6,7)8/h14,16-27,29-35,47,49,79H,15,28H2,1-13H3,(H,63,74)(H,65,75)(H,71,76)(H,72,78)/b40-14-/t34-,35+,47-,49-/m0/s1