ethyl 4-[(3,4-dimethoxyphenyl)methylcarbamothioylamino]benzoate

Systemtic Name: ethyl 4-[(3,4-dimethoxyphenyl)methylcarbamothioylamino]benzoate Openeye Name: ethyl 4-[(3,4-dimethoxyphenyl)methylcarbamothioylamino]benzoate CAS Name: 4-[[[(3,4-dimethoxyphenyl)methylamino]-sulfanylidenemethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[(3,4-dimethoxyphenyl)methylcarbamothioylamino]benzoate Traditional Name: 4-(veratrylthiocarbamoylamino)benzoic acid ethyl ester Formula: C19H22N2O4S MolecularWeight: 374.45398

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=S)NCC2=CC(=C(C=C2)OC)OC

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=S)NCC2=CC(=C(C=C2)OC)OC

InChI

InChI=1S/C19H22N2O4S/c1-4-25-18(22)14-6-8-15(9-7-14)21-19(26)20-12-13-5-10-16(23-2)17(11-13)24-3/h5-11H,4,12H2,1-3H3,(H2,20,21,26)