ethyl 4-[[(phenylmethyl)-propan-2-yl-carbamothioyl]amino]benzoate

Systemtic Name: ethyl 4-[[(phenylmethyl)-propan-2-yl-carbamothioyl]amino]benzoate Openeye Name: ethyl 4-[[benzyl(isopropyl)carbamothioyl]amino]benzoate CAS Name: 4-[[[(phenylmethyl)-propan-2-ylamino]-sulfanylidenemethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[benzyl(propan-2-yl)carbamothioyl]amino]benzoate Traditional Name: 4-[[benzyl(isopropyl)thiocarbamoyl]amino]benzoic acid ethyl ester Formula: C20H24N2O2S MolecularWeight: 356.48176

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H24N2O2S/c1-4-24-19(23)17-10-12-18(13-11-17)21-20(25)22(15(2)3)14-16-8-6-5-7-9-16/h5-13,15H,4,14H2,1-3H3,(H,21,25)