3-[3-[4-(2-cyanophenyl)phenyl]propanoylamino]thiophene-2-carboxylic acid

Systemtic Name: 3-[3-[4-(2-cyanophenyl)phenyl]propanoylamino]thiophene-2-carboxylic acid Openeye Name: 3-[3-[4-(2-cyanophenyl)phenyl]propanoylamino]thiophene-2-carboxylic acid CAS Name: 3-[[3-[4-(2-cyanophenyl)phenyl]-1-oxopropyl]amino]-2-thiophenecarboxylic acid IUPAC Name: 3-[3-[4-(2-cyanophenyl)phenyl]propanoylamino]thiophene-2-carboxylic acid Traditional Name: 3-[3-[4-(2-cyanophenyl)phenyl]propanoylamino]-2-thenoic acid Formula: C21H16N2O3S MolecularWeight: 376.42834

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C#N)C2=CC=C(C=C2)CCC(=O)NC3=C(SC=C3)C(=O)O

Isomeric SMILES

C1=CC=C(C(=C1)C#N)C2=CC=C(C=C2)CCC(=O)NC3=C(SC=C3)C(=O)O

InChI

InChI=1S/C21H16N2O3S/c22-13-16-3-1-2-4-17(16)15-8-5-14(6-9-15)7-10-19(24)23-18-11-12-27-20(18)21(25)26/h1-6,8-9,11-12H,7,10H2,(H,23,24)(H,25,26)