2-methyl-3-(naphthalen-1-ylcarbonylcarbamothioylamino)benzoic acid

Systemtic Name: 2-methyl-3-(naphthalen-1-ylcarbonylcarbamothioylamino)benzoic acid Openeye Name: 2-methyl-3-(naphthalene-1-carbonylcarbamothioylamino)benzoic acid CAS Name: 2-methyl-3-[[[[1-naphthalenyl(oxo)methyl]amino]-sulfanylidenemethyl]amino]benzoic acid IUPAC Name: 2-methyl-3-(naphthalene-1-carbonylcarbamothioylamino)benzoic acid Traditional Name: 2-methyl-3-(1-naphthoylthiocarbamoylamino)benzoic acid Formula: C20H16N2O3S MolecularWeight: 364.41764

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1NC(=S)NC(=O)C2=CC=CC3=CC=CC=C32)C(=O)O

Isomeric SMILES

CC1=C(C=CC=C1NC(=S)NC(=O)C2=CC=CC3=CC=CC=C32)C(=O)O

InChI

InChI=1S/C20H16N2O3S/c1-12-14(19(24)25)9-5-11-17(12)21-20(26)22-18(23)16-10-4-7-13-6-2-3-8-15(13)16/h2-11H,1H3,(H,24,25)(H2,21,22,23,26)