ethyl 4-[(3-methoxyphenyl)carbamothioylamino]benzoate

Systemtic Name: ethyl 4-[(3-methoxyphenyl)carbamothioylamino]benzoate Openeye Name: ethyl 4-[(3-methoxyphenyl)carbamothioylamino]benzoate CAS Name: 4-[[(3-methoxyanilino)-sulfanylidenemethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[(3-methoxyphenyl)carbamothioylamino]benzoate Traditional Name: 4-[(3-methoxyphenyl)thiocarbamoylamino]benzoic acid ethyl ester Formula: C17H18N2O3S MolecularWeight: 330.40142

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H18N2O3S/c1-3-22-16(20)12-7-9-13(10-8-12)18-17(23)19-14-5-4-6-15(11-14)21-2/h4-11H,3H2,1-2H3,(H2,18,19,23)