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

Systemtic Name: 4-[[5-methyl-2-(2-methylpropanoylamino)thiophen-3-yl]carbonylamino]benzoic acid Openeye Name: 4-[[5-methyl-2-(2-methylpropanoylamino)thiophene-3-carbonyl]amino]benzoic acid CAS Name: 4-[[[5-methyl-2-[(2-methyl-1-oxopropyl)amino]-3-thiophenyl]-oxomethyl]amino]benzoic acid IUPAC Name: 4-[[5-methyl-2-(2-methylpropanoylamino)thiophene-3-carbonyl]amino]benzoic acid Traditional Name: 4-[[2-(isobutyrylamino)-5-methyl-thiophene-3-carbonyl]amino]benzoic acid Formula: C17H18N2O4S MolecularWeight: 346.40082

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(S1)NC(=O)C(C)C)C(=O)NC2=CC=C(C=C2)C(=O)O

Isomeric SMILES

CC1=CC(=C(S1)NC(=O)C(C)C)C(=O)NC2=CC=C(C=C2)C(=O)O

InChI

InChI=1S/C17H18N2O4S/c1-9(2)14(20)19-16-13(8-10(3)24-16)15(21)18-12-6-4-11(5-7-12)17(22)23/h4-9H,1-3H3,(H,18,21)(H,19,20)(H,22,23)