ethyl 2-azanyl-4-[5-bis[[(2S)-1-ethoxy-1-oxidanylidene-butan-2-yl]amino]phosphorylfuran-2-yl]-1,3-thiazole-5-carboxylate

Systemtic Name: ethyl 2-azanyl-4-[5-bis[[(2S)-1-ethoxy-1-oxidanylidene-butan-2-yl]amino]phosphorylfuran-2-yl]-1,3-thiazole-5-carboxylate Openeye Name: ethyl 2-amino-4-[5-bis[[(1S)-1-ethoxycarbonylpropyl]amino]phosphoryl-2-furyl]thiazole-5-carboxylate CAS Name: 2-amino-4-[5-bis[[(2S)-1-ethoxy-1-oxobutan-2-yl]amino]phosphoryl-2-furanyl]-5-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-amino-4-[5-bis[[(2S)-1-ethoxy-1-oxobutan-2-yl]amino]phosphorylfuran-2-yl]-1,3-thiazole-5-carboxylate Traditional Name: 2-amino-4-[5-bis[[(1S)-1-carbethoxypropyl]amino]phosphoryl-2-furyl]thiazole-5-carboxylic acid ethyl ester Formula: C22H33N4O8PS MolecularWeight: 544.558181

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)OCC)NP(=O)(C1=CC=C(O1)C2=C(SC(=N2)N)C(=O)OCC)NC(CC)C(=O)OCC

Isomeric SMILES

CC[C@@H](C(=O)OCC)NP(=O)(C1=CC=C(O1)C2=C(SC(=N2)N)C(=O)OCC)N[C@@H](CC)C(=O)OCC

InChI

InChI=1S/C22H33N4O8PS/c1-6-13(19(27)31-8-3)25-35(30,26-14(7-2)20(28)32-9-4)16-12-11-15(34-16)17-18(21(29)33-10-5)36-22(23)24-17/h11-14H,6-10H2,1-5H3,(H2,23,24)(H2,25,26,30)/t13-,14-/m0/s1