2-(2,2-dimethylpropanoylamino)-4-(4-phenylphenyl)thiophene-3-carboxylic acid

Systemtic Name: 2-(2,2-dimethylpropanoylamino)-4-(4-phenylphenyl)thiophene-3-carboxylic acid Openeye Name: 2-(2,2-dimethylpropanoylamino)-4-(4-phenylphenyl)thiophene-3-carboxylic acid CAS Name: 2-[(2,2-dimethyl-1-oxopropyl)amino]-4-(4-phenylphenyl)-3-thiophenecarboxylic acid IUPAC Name: 2-(2,2-dimethylpropanoylamino)-4-(4-phenylphenyl)thiophene-3-carboxylic acid Traditional Name: 4-(4-phenylphenyl)-2-(pivaloylamino)-3-thenoic acid Formula: C22H21NO3S MolecularWeight: 379.47204

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)NC1=C(C(=CS1)C2=CC=C(C=C2)C3=CC=CC=C3)C(=O)O

Isomeric SMILES

CC(C)(C)C(=O)NC1=C(C(=CS1)C2=CC=C(C=C2)C3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C22H21NO3S/c1-22(2,3)21(26)23-19-18(20(24)25)17(13-27-19)16-11-9-15(10-12-16)14-7-5-4-6-8-14/h4-13H,1-3H3,(H,23,26)(H,24,25)