ethyl 4-[(3,5-dimethylphenyl)carbonylcarbamothioylamino]benzoate

Systemtic Name: ethyl 4-[(3,5-dimethylphenyl)carbonylcarbamothioylamino]benzoate Openeye Name: ethyl 4-[(3,5-dimethylbenzoyl)carbamothioylamino]benzoate CAS Name: 4-[[[[(3,5-dimethylphenyl)-oxomethyl]amino]-sulfanylidenemethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[(3,5-dimethylbenzoyl)carbamothioylamino]benzoate Traditional Name: 4-[(3,5-dimethylbenzoyl)thiocarbamoylamino]benzoic acid ethyl ester Formula: C19H20N2O3S MolecularWeight: 356.4387

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=S)NC(=O)C2=CC(=CC(=C2)C)C

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=S)NC(=O)C2=CC(=CC(=C2)C)C

InChI

InChI=1S/C19H20N2O3S/c1-4-24-18(23)14-5-7-16(8-6-14)20-19(25)21-17(22)15-10-12(2)9-13(3)11-15/h5-11H,4H2,1-3H3,(H2,20,21,22,25)