propan-2-yl 4-[(3-ethylphenyl)carbamothioylamino]benzoate

Systemtic Name: propan-2-yl 4-[(3-ethylphenyl)carbamothioylamino]benzoate Openeye Name: isopropyl 4-[(3-ethylphenyl)carbamothioylamino]benzoate CAS Name: 4-[[(3-ethylanilino)-sulfanylidenemethyl]amino]benzoic acid propan-2-yl ester IUPAC Name: propan-2-yl 4-[(3-ethylphenyl)carbamothioylamino]benzoate Traditional Name: 4-[(3-ethylphenyl)thiocarbamoylamino]benzoic acid isopropyl ester Formula: C19H22N2O2S MolecularWeight: 342.45518

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CC=C1)NC(=S)NC2=CC=C(C=C2)C(=O)OC(C)C

Isomeric SMILES

CCC1=CC(=CC=C1)NC(=S)NC2=CC=C(C=C2)C(=O)OC(C)C

InChI

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