propyl 4-[(2,3-dimethylphenyl)carbamothioylamino]benzoate

Systemtic Name: propyl 4-[(2,3-dimethylphenyl)carbamothioylamino]benzoate Openeye Name: propyl 4-[(2,3-dimethylphenyl)carbamothioylamino]benzoate CAS Name: 4-[[(2,3-dimethylanilino)-sulfanylidenemethyl]amino]benzoic acid propyl ester IUPAC Name: propyl 4-[(2,3-dimethylphenyl)carbamothioylamino]benzoate Traditional Name: 4-[(2,3-dimethylphenyl)thiocarbamoylamino]benzoic acid propyl ester Formula: C19H22N2O2S MolecularWeight: 342.45518

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=CC=C(C=C1)NC(=S)NC2=CC=CC(=C2C)C

Isomeric SMILES

CCCOC(=O)C1=CC=C(C=C1)NC(=S)NC2=CC=CC(=C2C)C

InChI

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