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

Systemtic Name: 3-[(2-acetamido-5-ethyl-thiophen-3-yl)carbonylamino]-4-methyl-benzoic acid Openeye Name: 3-[(2-acetamido-5-ethyl-thiophene-3-carbonyl)amino]-4-methyl-benzoic acid CAS Name: 3-[[(2-acetamido-5-ethyl-3-thiophenyl)-oxomethyl]amino]-4-methylbenzoic acid IUPAC Name: 3-[(2-acetamido-5-ethylthiophene-3-carbonyl)amino]-4-methylbenzoic acid Traditional Name: 3-[(2-acetamido-5-ethyl-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:

CCC1=CC(=C(S1)NC(=O)C)C(=O)NC2=C(C=CC(=C2)C(=O)O)C

Isomeric SMILES

CCC1=CC(=C(S1)NC(=O)C)C(=O)NC2=C(C=CC(=C2)C(=O)O)C

InChI

InChI=1S/C17H18N2O4S/c1-4-12-8-13(16(24-12)18-10(3)20)15(21)19-14-7-11(17(22)23)6-5-9(14)2/h5-8H,4H2,1-3H3,(H,18,20)(H,19,21)(H,22,23)