3-[(4-chlorophenyl)methyl-(2-cyclopentylethanoyl)amino]-5-phenyl-thiophene-2-carboxylic acid

Systemtic Name: 3-[(4-chlorophenyl)methyl-(2-cyclopentylethanoyl)amino]-5-phenyl-thiophene-2-carboxylic acid Openeye Name: 3-[(4-chlorophenyl)methyl-(2-cyclopentylacetyl)amino]-5-phenyl-thiophene-2-carboxylic acid CAS Name: 3-[(4-chlorophenyl)methyl-(2-cyclopentyl-1-oxoethyl)amino]-5-phenyl-2-thiophenecarboxylic acid IUPAC Name: 3-[(4-chlorophenyl)methyl-(2-cyclopentylacetyl)amino]-5-phenylthiophene-2-carboxylic acid Traditional Name: 3-[(4-chlorobenzyl)-(2-cyclopentylacetyl)amino]-5-phenyl-2-thenoic acid Formula: C25H24ClNO3S MolecularWeight: 453.98096

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)CC(=O)N(CC2=CC=C(C=C2)Cl)C3=C(SC(=C3)C4=CC=CC=C4)C(=O)O

Isomeric SMILES

C1CCC(C1)CC(=O)N(CC2=CC=C(C=C2)Cl)C3=C(SC(=C3)C4=CC=CC=C4)C(=O)O

InChI

InChI=1S/C25H24ClNO3S/c26-20-12-10-18(11-13-20)16-27(23(28)14-17-6-4-5-7-17)21-15-22(31-24(21)25(29)30)19-8-2-1-3-9-19/h1-3,8-13,15,17H,4-7,14,16H2,(H,29,30)