ethyl 3-[2,2-diphenylethanoylcarbamothioyl-(phenylmethyl)amino]propanoate

Systemtic Name: ethyl 3-[2,2-diphenylethanoylcarbamothioyl-(phenylmethyl)amino]propanoate Openeye Name: ethyl 3-[benzyl-[(2,2-diphenylacetyl)carbamothioyl]amino]propanoate CAS Name: 3-[[[(1-oxo-2,2-diphenylethyl)amino]-sulfanylidenemethyl]-(phenylmethyl)amino]propanoic acid ethyl ester IUPAC Name: ethyl 3-[benzyl-[(2,2-diphenylacetyl)carbamothioyl]amino]propanoate Traditional Name: 3-[benzyl-[(2,2-diphenylacetyl)thiocarbamoyl]amino]propionic acid ethyl ester Formula: C27H28N2O3S MolecularWeight: 460.58782

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCN(CC1=CC=CC=C1)C(=S)NC(=O)C(C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)CCN(CC1=CC=CC=C1)C(=S)NC(=O)C(C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C27H28N2O3S/c1-2-32-24(30)18-19-29(20-21-12-6-3-7-13-21)27(33)28-26(31)25(22-14-8-4-9-15-22)23-16-10-5-11-17-23/h3-17,25H,2,18-20H2,1H3,(H,28,31,33)