3-(ethanoylcarbamothioylamino)-4-methyl-benzoic acid

Systemtic Name: 3-(ethanoylcarbamothioylamino)-4-methyl-benzoic acid Openeye Name: 3-(acetylcarbamothioylamino)-4-methyl-benzoic acid CAS Name: 3-[[acetamido(sulfanylidene)methyl]amino]-4-methylbenzoic acid IUPAC Name: 3-(acetylcarbamothioylamino)-4-methylbenzoic acid Traditional Name: 3-(acetylthiocarbamoylamino)-4-methyl-benzoic acid Formula: C11H12N2O3S MolecularWeight: 252.28958

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)O)NC(=S)NC(=O)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)O)NC(=S)NC(=O)C

InChI

InChI=1S/C11H12N2O3S/c1-6-3-4-8(10(15)16)5-9(6)13-11(17)12-7(2)14/h3-5H,1-2H3,(H,15,16)(H2,12,13,14,17)