3-[(2-acetamido-4,5-dimethyl-thiophen-3-yl)carbonylamino]-4-methyl-benzoic acid

Systemtic Name: 3-[(2-acetamido-4,5-dimethyl-thiophen-3-yl)carbonylamino]-4-methyl-benzoic acid Openeye Name: 3-[(2-acetamido-4,5-dimethyl-thiophene-3-carbonyl)amino]-4-methyl-benzoic acid CAS Name: 3-[[(2-acetamido-4,5-dimethyl-3-thiophenyl)-oxomethyl]amino]-4-methylbenzoic acid IUPAC Name: 3-[(2-acetamido-4,5-dimethylthiophene-3-carbonyl)amino]-4-methylbenzoic acid Traditional Name: 3-[(2-acetamido-4,5-dimethyl-thiophene-3-carbonyl)amino]-4-methyl-benzoic acid Formula: C17H18N2O4S MolecularWeight: 346.40082

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)O)NC(=O)C2=C(SC(=C2C)C)NC(=O)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)O)NC(=O)C2=C(SC(=C2C)C)NC(=O)C

InChI

InChI=1S/C17H18N2O4S/c1-8-5-6-12(17(22)23)7-13(8)19-15(21)14-9(2)10(3)24-16(14)18-11(4)20/h5-7H,1-4H3,(H,18,20)(H,19,21)(H,22,23)