3-(2-cyclopentylpent-4-enoylamino)-5-phenyl-thiophene-2-carboxylic acid

Systemtic Name: 3-(2-cyclopentylpent-4-enoylamino)-5-phenyl-thiophene-2-carboxylic acid Openeye Name: 3-(2-cyclopentylpent-4-enoylamino)-5-phenyl-thiophene-2-carboxylic acid CAS Name: 3-[(2-cyclopentyl-1-oxopent-4-enyl)amino]-5-phenyl-2-thiophenecarboxylic acid IUPAC Name: 3-(2-cyclopentylpent-4-enoylamino)-5-phenylthiophene-2-carboxylic acid Traditional Name: 3-(2-cyclopentylpent-4-enoylamino)-5-phenyl-2-thenoic acid Formula: C21H23NO3S MolecularWeight: 369.47722

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Descriptors Computed from Structure

Canonical SMILES:

C=CCC(C1CCCC1)C(=O)NC2=C(SC(=C2)C3=CC=CC=C3)C(=O)O

Isomeric SMILES

C=CCC(C1CCCC1)C(=O)NC2=C(SC(=C2)C3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C21H23NO3S/c1-2-8-16(14-9-6-7-10-14)20(23)22-17-13-18(26-19(17)21(24)25)15-11-4-3-5-12-15/h2-5,11-14,16H,1,6-10H2,(H,22,23)(H,24,25)