methyl 2-[acetamidomethyl-[2-[2-(acetamidomethylsulfanyl)ethanoylamino]ethanoyl]amino]-3-sulfanyl-propanoate

Systemtic Name: methyl 2-[acetamidomethyl-[2-[2-(acetamidomethylsulfanyl)ethanoylamino]ethanoyl]amino]-3-sulfanyl-propanoate Openeye Name: methyl 2-[acetamidomethyl-[2-[[2-(acetamidomethylsulfanyl)acetyl]amino]acetyl]amino]-3-sulfanyl-propanoate CAS Name: 2-[acetamidomethyl-[2-[[2-(acetamidomethylthio)-1-oxoethyl]amino]-1-oxoethyl]amino]-3-mercaptopropanoic acid methyl ester IUPAC Name: methyl 2-[acetamidomethyl-[2-[[2-(acetamidomethylsulfanyl)acetyl]amino]acetyl]amino]-3-sulfanylpropanoate Traditional Name: 2-[acetamidomethyl-[2-[[2-(acetamidomethylthio)acetyl]amino]acetyl]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)CNC(=O)CSCNC(=O)C

Isomeric SMILES

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

InChI

InChI=1S/C14H24N4O6S2/c1-9(19)16-7-18(11(5-25)14(23)24-3)13(22)4-15-12(21)6-26-8-17-10(2)20/h11,25H,4-8H2,1-3H3,(H,15,21)(H,16,19)(H,17,20)