4-methoxy-3-[(3,4,5-trimethoxyphenyl)carbonylcarbamothioylamino]benzoate

Systemtic Name: 4-methoxy-3-[(3,4,5-trimethoxyphenyl)carbonylcarbamothioylamino]benzoate Openeye Name: 4-methoxy-3-[(3,4,5-trimethoxybenzoyl)carbamothioylamino]benzoate CAS Name: 4-methoxy-3-[[[[oxo-(3,4,5-trimethoxyphenyl)methyl]amino]-sulfanylidenemethyl]amino]benzoate IUPAC Name: 4-methoxy-3-[(3,4,5-trimethoxybenzoyl)carbamothioylamino]benzoate Traditional Name: 4-methoxy-3-[(3,4,5-trimethoxybenzoyl)thiocarbamoylamino]benzoate Formula: C19H19N2O7S- MolecularWeight: 419.42836

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)[O-])NC(=S)NC(=O)C2=CC(=C(C(=C2)OC)OC)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)[O-])NC(=S)NC(=O)C2=CC(=C(C(=C2)OC)OC)OC

InChI

InChI=1S/C19H20N2O7S/c1-25-13-6-5-10(18(23)24)7-12(13)20-19(29)21-17(22)11-8-14(26-2)16(28-4)15(9-11)27-3/h5-9H,1-4H3,(H,23,24)(H2,20,21,22,29)/p-1