ethyl 2-[[2-phenyl-2-[phenylcarbonyl-(phenylmethyl)amino]ethanethioyl]amino]ethanoate

Systemtic Name: ethyl 2-[[2-phenyl-2-[phenylcarbonyl-(phenylmethyl)amino]ethanethioyl]amino]ethanoate Openeye Name: ethyl 2-[[2-[benzoyl(benzyl)amino]-2-phenyl-ethanethioyl]amino]acetate CAS Name: 2-[[2-[benzoyl-(phenylmethyl)amino]-2-phenyl-1-sulfanylideneethyl]amino]acetic acid ethyl ester IUPAC Name: ethyl 2-[[2-[benzoyl(benzyl)amino]-2-phenylethanethioyl]amino]acetate Traditional Name: 2-[[2-[benzoyl(benzyl)amino]-2-phenyl-thioacetyl]amino]acetic acid ethyl ester Formula: C26H26N2O3S MolecularWeight: 446.56124

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CNC(=S)C(C1=CC=CC=C1)N(CC2=CC=CC=C2)C(=O)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)CNC(=S)C(C1=CC=CC=C1)N(CC2=CC=CC=C2)C(=O)C3=CC=CC=C3

InChI

InChI=1S/C26H26N2O3S/c1-2-31-23(29)18-27-25(32)24(21-14-8-4-9-15-21)28(19-20-12-6-3-7-13-20)26(30)22-16-10-5-11-17-22/h3-17,24H,2,18-19H2,1H3,(H,27,32)