ethyl 3-[2-phenylethanoylcarbamothioyl-(phenylmethyl)amino]propanoate

Systemtic Name: ethyl 3-[2-phenylethanoylcarbamothioyl-(phenylmethyl)amino]propanoate Openeye Name: ethyl 3-[benzyl-[(2-phenylacetyl)carbamothioyl]amino]propanoate CAS Name: 3-[[[(1-oxo-2-phenylethyl)amino]-sulfanylidenemethyl]-(phenylmethyl)amino]propanoic acid ethyl ester IUPAC Name: ethyl 3-[benzyl-[(2-phenylacetyl)carbamothioyl]amino]propanoate Traditional Name: 3-[benzyl-[(2-phenylacetyl)thiocarbamoyl]amino]propionic acid ethyl ester Formula: C21H24N2O3S MolecularWeight: 384.49186

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCN(CC1=CC=CC=C1)C(=S)NC(=O)CC2=CC=CC=C2

Isomeric SMILES

CCOC(=O)CCN(CC1=CC=CC=C1)C(=S)NC(=O)CC2=CC=CC=C2

InChI

InChI=1S/C21H24N2O3S/c1-2-26-20(25)13-14-23(16-18-11-7-4-8-12-18)21(27)22-19(24)15-17-9-5-3-6-10-17/h3-12H,2,13-16H2,1H3,(H,22,24,27)