4-[(4-methoxyphenyl)carbamothioylamino]benzoic acid

Systemtic Name: 4-[(4-methoxyphenyl)carbamothioylamino]benzoic acid Openeye Name: 4-[(4-methoxyphenyl)carbamothioylamino]benzoic acid CAS Name: 4-[[(4-methoxyanilino)-sulfanylidenemethyl]amino]benzoic acid IUPAC Name: 4-[(4-methoxyphenyl)carbamothioylamino]benzoic acid Traditional Name: 4-[(4-methoxyphenyl)thiocarbamoylamino]benzoic acid Formula: C15H14N2O3S MolecularWeight: 302.34826

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=S)NC2=CC=C(C=C2)C(=O)O

Isomeric SMILES

COC1=CC=C(C=C1)NC(=S)NC2=CC=C(C=C2)C(=O)O

InChI

InChI=1S/C15H14N2O3S/c1-20-13-8-6-12(7-9-13)17-15(21)16-11-4-2-10(3-5-11)14(18)19/h2-9H,1H3,(H,18,19)(H2,16,17,21)