methyl (2R)-2-[[(2S)-2-azanylpropanoyl]amino]-5-[[(2S)-1-[[(2R)-1-[[(2R)-1-methoxy-1-oxidanylidene-propan-2-yl]amino]-1-oxidanylidene-propan-2-yl]amino]-1-oxidanylidene-6-[2,2,2-tris(fluoranyl)ethanoylamino]hexan-2-yl]amino]-5-oxidanylidene-pentanoate

Systemtic Name: methyl (2R)-2-[[(2S)-2-azanylpropanoyl]amino]-5-[[(2S)-1-[[(2R)-1-[[(2R)-1-methoxy-1-oxidanylidene-propan-2-yl]amino]-1-oxidanylidene-propan-2-yl]amino]-1-oxidanylidene-6-[2,2,2-tris(fluoranyl)ethanoylamino]hexan-2-yl]amino]-5-oxidanylidene-pentanoate Openeye Name: methyl (2R)-2-[[(2S)-2-aminopropanoyl]amino]-5-[[(1S)-1-[[(1R)-2-[[(1R)-2-methoxy-1-methyl-2-oxo-ethyl]amino]-1-methyl-2-oxo-ethyl]carbamoyl]-5-[(2,2,2-trifluoroacetyl)amino]pentyl]amino]-5-oxo-pentanoate CAS Name: (2R)-2-[[(2S)-2-amino-1-oxopropyl]amino]-5-[[(2S)-1-[[(2R)-1-[[(2R)-1-methoxy-1-oxopropan-2-yl]amino]-1-oxopropan-2-yl]amino]-1-oxo-6-[(2,2,2-trifluoro-1-oxoethyl)amino]hexan-2-yl]amino]-5-oxopentanoic acid methyl ester IUPAC Name: methyl (2R)-2-[[(2S)-2-aminopropanoyl]amino]-5-[[(2S)-1-[[(2R)-1-[[(2R)-1-methoxy-1-oxopropan-2-yl]amino]-1-oxopropan-2-yl]amino]-1-oxo-6-[(2,2,2-trifluoroacetyl)amino]hexan-2-yl]amino]-5-oxopentanoate Traditional Name: (2R)-2-[[(2S)-2-aminopropanoyl]amino]-5-keto-5-[[(1S)-1-[[(1R)-2-keto-2-[[(1R)-2-keto-2-methoxy-1-methyl-ethyl]amino]-1-methyl-ethyl]carbamoyl]-5-[(2,2,2-trifluoroacetyl)amino]pentyl]amino]valeric acid methyl ester Formula: C24H39F3N6O9 MolecularWeight: 612.59647

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(CCC(=O)NC(CCCCNC(=O)C(F)(F)F)C(=O)NC(C)C(=O)NC(C)C(=O)OC)C(=O)OC)N

Isomeric SMILES

C[C@@H](C(=O)N[C@H](CCC(=O)N[C@@H](CCCCNC(=O)C(F)(F)F)C(=O)N[C@H](C)C(=O)N[C@H](C)C(=O)OC)C(=O)OC)N

InChI

InChI=1S/C24H39F3N6O9/c1-12(28)18(35)33-16(22(39)42-5)9-10-17(34)32-15(8-6-7-11-29-23(40)24(25,26)27)20(37)30-13(2)19(36)31-14(3)21(38)41-4/h12-16H,6-11,28H2,1-5H3,(H,29,40)(H,30,37)(H,31,36)(H,32,34)(H,33,35)/t12-,13+,14+,15-,16+/m0/s1