methyl 2-[[2-acetamido-3-(phenylmethylsulfanyl)propanoyl]amino]-3-(triphenylmethyl)sulfanyl-propanoate

Systemtic Name: methyl 2-[[2-acetamido-3-(phenylmethylsulfanyl)propanoyl]amino]-3-(triphenylmethyl)sulfanyl-propanoate Openeye Name: methyl 2-[(2-acetamido-3-benzylsulfanyl-propanoyl)amino]-3-tritylsulfanyl-propanoate CAS Name: 2-[[2-acetamido-1-oxo-3-(phenylmethylthio)propyl]amino]-3-[(triphenylmethyl)thio]propanoic acid methyl ester IUPAC Name: methyl 2-[(2-acetamido-3-benzylsulfanylpropanoyl)amino]-3-tritylsulfanylpropanoate Traditional Name: 2-[[2-acetamido-3-(benzylthio)propanoyl]amino]-3-(tritylthio)propionic acid methyl ester Formula: C35H36N2O4S2 MolecularWeight: 612.80134

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CSCC1=CC=CC=C1)C(=O)NC(CSC(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)C(=O)OC

Isomeric SMILES

CC(=O)NC(CSCC1=CC=CC=C1)C(=O)NC(CSC(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)C(=O)OC

InChI

InChI=1S/C35H36N2O4S2/c1-26(38)36-31(24-42-23-27-15-7-3-8-16-27)33(39)37-32(34(40)41-2)25-43-35(28-17-9-4-10-18-28,29-19-11-5-12-20-29)30-21-13-6-14-22-30/h3-22,31-32H,23-25H2,1-2H3,(H,36,38)(H,37,39)