propan-2-yl 4-[(4-ethanoylphenyl)carbamothioylamino]benzoate

Systemtic Name: propan-2-yl 4-[(4-ethanoylphenyl)carbamothioylamino]benzoate Openeye Name: isopropyl 4-[(4-acetylphenyl)carbamothioylamino]benzoate CAS Name: 4-[[(4-acetylanilino)-sulfanylidenemethyl]amino]benzoic acid propan-2-yl ester IUPAC Name: propan-2-yl 4-[(4-acetylphenyl)carbamothioylamino]benzoate Traditional Name: 4-[(4-acetylphenyl)thiocarbamoylamino]benzoic acid isopropyl ester Formula: C19H20N2O3S MolecularWeight: 356.4387

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C1=CC=C(C=C1)NC(=S)NC2=CC=C(C=C2)C(=O)C

Isomeric SMILES

CC(C)OC(=O)C1=CC=C(C=C1)NC(=S)NC2=CC=C(C=C2)C(=O)C

InChI

InChI=1S/C19H20N2O3S/c1-12(2)24-18(23)15-6-10-17(11-7-15)21-19(25)20-16-8-4-14(5-9-16)13(3)22/h4-12H,1-3H3,(H2,20,21,25)