propyl 4-(2-phenylethanoylcarbamothioylamino)benzoate

Systemtic Name: propyl 4-(2-phenylethanoylcarbamothioylamino)benzoate Openeye Name: propyl 4-[(2-phenylacetyl)carbamothioylamino]benzoate CAS Name: 4-[[[(1-oxo-2-phenylethyl)amino]-sulfanylidenemethyl]amino]benzoic acid propyl ester IUPAC Name: propyl 4-[(2-phenylacetyl)carbamothioylamino]benzoate Traditional Name: 4-[(2-phenylacetyl)thiocarbamoylamino]benzoic acid propyl ester Formula: C19H20N2O3S MolecularWeight: 356.4387

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=CC=C(C=C1)NC(=S)NC(=O)CC2=CC=CC=C2

Isomeric SMILES

CCCOC(=O)C1=CC=C(C=C1)NC(=S)NC(=O)CC2=CC=CC=C2

InChI

InChI=1S/C19H20N2O3S/c1-2-12-24-18(23)15-8-10-16(11-9-15)20-19(25)21-17(22)13-14-6-4-3-5-7-14/h3-11H,2,12-13H2,1H3,(H2,20,21,22,25)