methyl 2-(2-benzamidoethanoylamino)-3-[[2-(2-benzamidoethanoylamino)-3-methoxy-3-oxidanylidene-propyl]disulfanyl]propanoate

Systemtic Name: methyl 2-(2-benzamidoethanoylamino)-3-[[2-(2-benzamidoethanoylamino)-3-methoxy-3-oxidanylidene-propyl]disulfanyl]propanoate Openeye Name: methyl 2-[(2-benzamidoacetyl)amino]-3-[[2-[(2-benzamidoacetyl)amino]-3-methoxy-3-oxo-propyl]disulfanyl]propanoate CAS Name: 2-[(2-benzamido-1-oxoethyl)amino]-3-[[2-[(2-benzamido-1-oxoethyl)amino]-3-methoxy-3-oxopropyl]disulfanyl]propanoic acid methyl ester IUPAC Name: methyl 2-[(2-benzamidoacetyl)amino]-3-[[2-[(2-benzamidoacetyl)amino]-3-methoxy-3-oxopropyl]disulfanyl]propanoate Traditional Name: 2-(hippuroylamino)-3-[[2-(hippuroylamino)-3-keto-3-methoxy-propyl]disulfanyl]propionic acid methyl ester Formula: C26H30N4O8S2 MolecularWeight: 590.6684

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CSSCC(C(=O)OC)NC(=O)CNC(=O)C1=CC=CC=C1)NC(=O)CNC(=O)C2=CC=CC=C2

Isomeric SMILES

COC(=O)C(CSSCC(C(=O)OC)NC(=O)CNC(=O)C1=CC=CC=C1)NC(=O)CNC(=O)C2=CC=CC=C2

InChI

InChI=1S/C26H30N4O8S2/c1-37-25(35)19(29-21(31)13-27-23(33)17-9-5-3-6-10-17)15-39-40-16-20(26(36)38-2)30-22(32)14-28-24(34)18-11-7-4-8-12-18/h3-12,19-20H,13-16H2,1-2H3,(H,27,33)(H,28,34)(H,29,31)(H,30,32)