propyl 4-[(2,5-dimethylphenyl)carbamothioylamino]benzoate

Systemtic Name: propyl 4-[(2,5-dimethylphenyl)carbamothioylamino]benzoate Openeye Name: propyl 4-[(2,5-dimethylphenyl)carbamothioylamino]benzoate CAS Name: 4-[[(2,5-dimethylanilino)-sulfanylidenemethyl]amino]benzoic acid propyl ester IUPAC Name: propyl 4-[(2,5-dimethylphenyl)carbamothioylamino]benzoate Traditional Name: 4-[(2,5-dimethylphenyl)thiocarbamoylamino]benzoic acid propyl ester Formula: C19H22N2O2S MolecularWeight: 342.45518

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H22N2O2S/c1-4-11-23-18(22)15-7-9-16(10-8-15)20-19(24)21-17-12-13(2)5-6-14(17)3/h5-10,12H,4,11H2,1-3H3,(H2,20,21,24)