methyl 2-[3-(phenylmethoxycarbonylamino)propanoylamino]-3-(triphenylmethyl)sulfanyl-propanoate

Systemtic Name: methyl 2-[3-(phenylmethoxycarbonylamino)propanoylamino]-3-(triphenylmethyl)sulfanyl-propanoate Openeye Name: methyl 2-[3-(benzyloxycarbonylamino)propanoylamino]-3-tritylsulfanyl-propanoate CAS Name: 2-[[1-oxo-3-(phenylmethoxycarbonylamino)propyl]amino]-3-[(triphenylmethyl)thio]propanoic acid methyl ester IUPAC Name: methyl 2-[3-(phenylmethoxycarbonylamino)propanoylamino]-3-tritylsulfanylpropanoate Traditional Name: 2-[3-(benzyloxycarbonylamino)propanoylamino]-3-(tritylthio)propionic acid methyl ester Formula: C34H34N2O5S MolecularWeight: 582.70916

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CSC(C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3)NC(=O)CCNC(=O)OCC4=CC=CC=C4

Isomeric SMILES

COC(=O)C(CSC(C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3)NC(=O)CCNC(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C34H34N2O5S/c1-40-32(38)30(36-31(37)22-23-35-33(39)41-24-26-14-6-2-7-15-26)25-42-34(27-16-8-3-9-17-27,28-18-10-4-11-19-28)29-20-12-5-13-21-29/h2-21,30H,22-25H2,1H3,(H,35,39)(H,36,37)