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2-[methyl-[(4-methylphenyl)carbonylcarbamothioyl]amino]benzoic acid

2-[methyl-[(4-methylphenyl)carbonylcarbamothioyl]amino]benzoic acid

Systemtic Name:2-[methyl-[(4-methylphenyl)carbonylcarbamothioyl]amino]benzoic acid
Openeye Name:2-[methyl-[(4-methylbenzoyl)carbamothioyl]amino]benzoic acid
CAS Name:2-[methyl-[[[(4-methylphenyl)-oxomethyl]amino]-sulfanylidenemethyl]amino]benzoic acid
IUPAC Name:2-[methyl-[(4-methylbenzoyl)carbamothioyl]amino]benzoic acid
Traditional Name:2-[methyl(p-toluoylthiocarbamoyl)amino]benzoic acid
Formula: C17H16N2O3S
MolecularWeight: 328.38554
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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)NC(=S)N(C)C2=CC=CC=C2C(=O)O


Isomeric SMILES

CC1=CC=C(C=C1)C(=O)NC(=S)N(C)C2=CC=CC=C2C(=O)O


InChI

InChI=1S/C17H16N2O3S/c1-11-7-9-12(10-8-11)15(20)18-17(23)19(2)14-6-4-3-5-13(14)16(21)22/h3-10H,1-2H3,(H,21,22)(H,18,20,23)


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