4-(3,4-dimethoxyphenyl)-5-methyl-2-(2-methylpropanoylamino)thiophene-3-carboxylic acid

Systemtic Name: 4-(3,4-dimethoxyphenyl)-5-methyl-2-(2-methylpropanoylamino)thiophene-3-carboxylic acid Openeye Name: 4-(3,4-dimethoxyphenyl)-5-methyl-2-(2-methylpropanoylamino)thiophene-3-carboxylic acid CAS Name: 4-(3,4-dimethoxyphenyl)-5-methyl-2-[(2-methyl-1-oxopropyl)amino]-3-thiophenecarboxylic acid IUPAC Name: 4-(3,4-dimethoxyphenyl)-5-methyl-2-(2-methylpropanoylamino)thiophene-3-carboxylic acid Traditional Name: 4-(3,4-dimethoxyphenyl)-2-(isobutyrylamino)-5-methyl-3-thenoic acid Formula: C18H21NO5S MolecularWeight: 363.42804

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H21NO5S/c1-9(2)16(20)19-17-15(18(21)22)14(10(3)25-17)11-6-7-12(23-4)13(8-11)24-5/h6-9H,1-5H3,(H,19,20)(H,21,22)