ethyl 4-[[(3,5-dimethoxyphenyl)carbonylamino]carbamothioylamino]benzoate

Systemtic Name: ethyl 4-[[(3,5-dimethoxyphenyl)carbonylamino]carbamothioylamino]benzoate Openeye Name: ethyl 4-[[(3,5-dimethoxybenzoyl)amino]carbamothioylamino]benzoate CAS Name: 4-[[[[(3,5-dimethoxyphenyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[(3,5-dimethoxybenzoyl)amino]carbamothioylamino]benzoate Traditional Name: 4-[[(3,5-dimethoxybenzoyl)amino]thiocarbamoylamino]benzoic acid ethyl ester Formula: C19H21N3O5S MolecularWeight: 403.45214

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H21N3O5S/c1-4-27-18(24)12-5-7-14(8-6-12)20-19(28)22-21-17(23)13-9-15(25-2)11-16(10-13)26-3/h5-11H,4H2,1-3H3,(H,21,23)(H2,20,22,28)