(phenylmethyl) 3-[[3-oxidanylidene-3-phenylmethoxy-2-(phenylmethoxycarbonylamino)propyl]disulfanyl]-2-(phenylmethoxycarbonylamino)propanoate

Systemtic Name: (phenylmethyl) 3-[[3-oxidanylidene-3-phenylmethoxy-2-(phenylmethoxycarbonylamino)propyl]disulfanyl]-2-(phenylmethoxycarbonylamino)propanoate Openeye Name: benzyl 3-[[3-benzyloxy-2-(benzyloxycarbonylamino)-3-oxo-propyl]disulfanyl]-2-(benzyloxycarbonylamino)propanoate CAS Name: 3-[[3-oxo-3-phenylmethoxy-2-(phenylmethoxycarbonylamino)propyl]disulfanyl]-2-(phenylmethoxycarbonylamino)propanoic acid (phenylmethyl) ester IUPAC Name: benzyl 3-[[3-oxo-3-phenylmethoxy-2-(phenylmethoxycarbonylamino)propyl]disulfanyl]-2-(phenylmethoxycarbonylamino)propanoate Traditional Name: 3-[[3-benzoxy-2-(benzyloxycarbonylamino)-3-keto-propyl]disulfanyl]-2-(benzyloxycarbonylamino)propionic acid benzyl ester Formula: C36H36N2O8S2 MolecularWeight: 688.80964

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)C(CSSCC(C(=O)OCC2=CC=CC=C2)NC(=O)OCC3=CC=CC=C3)NC(=O)OCC4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)C(CSSCC(C(=O)OCC2=CC=CC=C2)NC(=O)OCC3=CC=CC=C3)NC(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C36H36N2O8S2/c39-33(43-21-27-13-5-1-6-14-27)31(37-35(41)45-23-29-17-9-3-10-18-29)25-47-48-26-32(34(40)44-22-28-15-7-2-8-16-28)38-36(42)46-24-30-19-11-4-12-20-30/h1-20,31-32H,21-26H2,(H,37,41)(H,38,42)