2-[(2,6-dimethoxyphenyl)carbonylcarbamothioylamino]benzoic acid

Systemtic Name: 2-[(2,6-dimethoxyphenyl)carbonylcarbamothioylamino]benzoic acid Openeye Name: 2-[(2,6-dimethoxybenzoyl)carbamothioylamino]benzoic acid CAS Name: 2-[[[[(2,6-dimethoxyphenyl)-oxomethyl]amino]-sulfanylidenemethyl]amino]benzoic acid IUPAC Name: 2-[(2,6-dimethoxybenzoyl)carbamothioylamino]benzoic acid Traditional Name: 2-[(2,6-dimethoxybenzoyl)thiocarbamoylamino]benzoic acid Formula: C17H16N2O5S MolecularWeight: 360.38434

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC=C1)OC)C(=O)NC(=S)NC2=CC=CC=C2C(=O)O

Isomeric SMILES

COC1=C(C(=CC=C1)OC)C(=O)NC(=S)NC2=CC=CC=C2C(=O)O

InChI

InChI=1S/C17H16N2O5S/c1-23-12-8-5-9-13(24-2)14(12)15(20)19-17(25)18-11-7-4-3-6-10(11)16(21)22/h3-9H,1-2H3,(H,21,22)(H2,18,19,20,25)