propyl 4-[(3,4-dimethoxyphenyl)carbonylcarbamothioylamino]benzoate

Systemtic Name: propyl 4-[(3,4-dimethoxyphenyl)carbonylcarbamothioylamino]benzoate Openeye Name: propyl 4-[(3,4-dimethoxybenzoyl)carbamothioylamino]benzoate CAS Name: 4-[[[[(3,4-dimethoxyphenyl)-oxomethyl]amino]-sulfanylidenemethyl]amino]benzoic acid propyl ester IUPAC Name: propyl 4-[(3,4-dimethoxybenzoyl)carbamothioylamino]benzoate Traditional Name: 4-(veratroylthiocarbamoylamino)benzoic acid propyl ester Formula: C20H22N2O5S MolecularWeight: 402.46408

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=CC=C(C=C1)NC(=S)NC(=O)C2=CC(=C(C=C2)OC)OC

Isomeric SMILES

CCCOC(=O)C1=CC=C(C=C1)NC(=S)NC(=O)C2=CC(=C(C=C2)OC)OC

InChI

InChI=1S/C20H22N2O5S/c1-4-11-27-19(24)13-5-8-15(9-6-13)21-20(28)22-18(23)14-7-10-16(25-2)17(12-14)26-3/h5-10,12H,4,11H2,1-3H3,(H2,21,22,23,28)