ethyl 4-[[(phenylmethyl)-propyl-carbamothioyl]amino]benzoate

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CC1=CC=CC=C1)C(=S)NC2=CC=C(C=C2)C(=O)OCC

Isomeric SMILES

CCCN(CC1=CC=CC=C1)C(=S)NC2=CC=C(C=C2)C(=O)OCC

InChI

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