methyl 5-[(2-azanyl-2-ethanoylsulfanyl-4-methyl-pentanoyl)-[1-(methylamino)-1-oxidanylidene-3-phenyl-propan-2-yl]amino]-5-oxidanylidene-pentanoate

Systemtic Name: methyl 5-[(2-azanyl-2-ethanoylsulfanyl-4-methyl-pentanoyl)-[1-(methylamino)-1-oxidanylidene-3-phenyl-propan-2-yl]amino]-5-oxidanylidene-pentanoate Openeye Name: methyl 5-[(2-acetylsulfanyl-2-amino-4-methyl-pentanoyl)-[1-benzyl-2-(methylamino)-2-oxo-ethyl]amino]-5-oxo-pentanoate CAS Name: 5-[[2-(acetylthio)-2-amino-4-methyl-1-oxopentyl]-[1-(methylamino)-1-oxo-3-phenylpropan-2-yl]amino]-5-oxopentanoic acid methyl ester IUPAC Name: methyl 5-[(2-acetylsulfanyl-2-amino-4-methylpentanoyl)-[1-(methylamino)-1-oxo-3-phenylpropan-2-yl]amino]-5-oxopentanoate Traditional Name: 5-[[2-(acetylthio)-2-amino-4-methyl-pentanoyl]-[1-benzyl-2-keto-2-(methylamino)ethyl]amino]-5-keto-valeric acid methyl ester Formula: C24H35N3O6S MolecularWeight: 493.6162

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)N(C(CC1=CC=CC=C1)C(=O)NC)C(=O)CCCC(=O)OC)(N)SC(=O)C

Isomeric SMILES

CC(C)CC(C(=O)N(C(CC1=CC=CC=C1)C(=O)NC)C(=O)CCCC(=O)OC)(N)SC(=O)C

InChI

InChI=1S/C24H35N3O6S/c1-16(2)15-24(25,34-17(3)28)23(32)27(20(29)12-9-13-21(30)33-5)19(22(31)26-4)14-18-10-7-6-8-11-18/h6-8,10-11,16,19H,9,12-15,25H2,1-5H3,(H,26,31)