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

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

Systemtic Name:4-methoxy-3-[(3,4,5-trimethoxyphenyl)carbonylcarbamothioylamino]benzoic acid
Openeye Name:4-methoxy-3-[(3,4,5-trimethoxybenzoyl)carbamothioylamino]benzoic acid
CAS Name:4-methoxy-3-[[[[oxo-(3,4,5-trimethoxyphenyl)methyl]amino]-sulfanylidenemethyl]amino]benzoic acid
IUPAC Name:4-methoxy-3-[(3,4,5-trimethoxybenzoyl)carbamothioylamino]benzoic acid
Traditional Name:4-methoxy-3-[(3,4,5-trimethoxybenzoyl)thiocarbamoylamino]benzoic acid
Formula: C19H20N2O7S
MolecularWeight: 420.4363
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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)


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