methyl 2-azanyl-5-[[1-[(2-methoxy-2-oxidanylidene-1-phenyl-ethyl)amino]-1-oxidanylidene-3-(phenylmethylsulfanyl)propan-2-yl]amino]-5-oxidanylidene-pentanoate

Systemtic Name: methyl 2-azanyl-5-[[1-[(2-methoxy-2-oxidanylidene-1-phenyl-ethyl)amino]-1-oxidanylidene-3-(phenylmethylsulfanyl)propan-2-yl]amino]-5-oxidanylidene-pentanoate Openeye Name: methyl 2-amino-5-[[1-(benzylsulfanylmethyl)-2-[(2-methoxy-2-oxo-1-phenyl-ethyl)amino]-2-oxo-ethyl]amino]-5-oxo-pentanoate CAS Name: 2-amino-5-[[1-[(2-methoxy-2-oxo-1-phenylethyl)amino]-1-oxo-3-(phenylmethylthio)propan-2-yl]amino]-5-oxopentanoic acid methyl ester IUPAC Name: methyl 2-amino-5-[[3-benzylsulfanyl-1-[(2-methoxy-2-oxo-1-phenylethyl)amino]-1-oxopropan-2-yl]amino]-5-oxopentanoate Traditional Name: 2-amino-5-[[1-[(benzylthio)methyl]-2-keto-2-[(2-keto-2-methoxy-1-phenyl-ethyl)amino]ethyl]amino]-5-keto-valeric acid methyl ester Formula: C25H31N3O6S MolecularWeight: 501.59514

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CCC(=O)NC(CSCC1=CC=CC=C1)C(=O)NC(C2=CC=CC=C2)C(=O)OC)N

Isomeric SMILES

COC(=O)C(CCC(=O)NC(CSCC1=CC=CC=C1)C(=O)NC(C2=CC=CC=C2)C(=O)OC)N

InChI

InChI=1S/C25H31N3O6S/c1-33-24(31)19(26)13-14-21(29)27-20(16-35-15-17-9-5-3-6-10-17)23(30)28-22(25(32)34-2)18-11-7-4-8-12-18/h3-12,19-20,22H,13-16,26H2,1-2H3,(H,27,29)(H,28,30)