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

Systemtic Name: 4-methyl-3-(naphthalen-2-ylcarbonylcarbamothioylamino)benzoic acid Openeye Name: 4-methyl-3-(naphthalene-2-carbonylcarbamothioylamino)benzoic acid CAS Name: 4-methyl-3-[[[[2-naphthalenyl(oxo)methyl]amino]-sulfanylidenemethyl]amino]benzoic acid IUPAC Name: 4-methyl-3-(naphthalene-2-carbonylcarbamothioylamino)benzoic acid Traditional Name: 4-methyl-3-(2-naphthoylthiocarbamoylamino)benzoic acid Formula: C20H16N2O3S MolecularWeight: 364.41764

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)O)NC(=S)NC(=O)C2=CC3=CC=CC=C3C=C2

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)O)NC(=S)NC(=O)C2=CC3=CC=CC=C3C=C2

InChI

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