methyl 2-[acetamidomethyl-[4-(acetamidomethylsulfanyl)-2-azanyl-3-oxidanylidene-butanoyl]amino]-3-sulfanyl-propanoate

Systemtic Name: methyl 2-[acetamidomethyl-[4-(acetamidomethylsulfanyl)-2-azanyl-3-oxidanylidene-butanoyl]amino]-3-sulfanyl-propanoate Openeye Name: methyl 2-[acetamidomethyl-[4-(acetamidomethylsulfanyl)-2-amino-3-oxo-butanoyl]amino]-3-sulfanyl-propanoate CAS Name: 2-[acetamidomethyl-[4-(acetamidomethylthio)-2-amino-1,3-dioxobutyl]amino]-3-mercaptopropanoic acid methyl ester IUPAC Name: methyl 2-[acetamidomethyl-[4-(acetamidomethylsulfanyl)-2-amino-3-oxobutanoyl]amino]-3-sulfanylpropanoate Traditional Name: 2-[acetamidomethyl-[4-(acetamidomethylthio)-2-amino-3-keto-butanoyl]amino]-3-mercapto-propionic acid methyl ester Formula: C14H24N4O6S2 MolecularWeight: 408.49356

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCN(C(CS)C(=O)OC)C(=O)C(C(=O)CSCNC(=O)C)N

Isomeric SMILES

CC(=O)NCN(C(CS)C(=O)OC)C(=O)C(C(=O)CSCNC(=O)C)N

InChI

InChI=1S/C14H24N4O6S2/c1-8(19)16-6-18(10(4-25)14(23)24-3)13(22)12(15)11(21)5-26-7-17-9(2)20/h10,12,25H,4-7,15H2,1-3H3,(H,16,19)(H,17,20)