3-(4-cyanophenyl)-1-cyclopentylcarbonyl-5-pyridin-3-yl-4-thiophen-2-ylcarbonyl-pyrrolidine-2-carboxylic acid

Systemtic Name: 3-(4-cyanophenyl)-1-cyclopentylcarbonyl-5-pyridin-3-yl-4-thiophen-2-ylcarbonyl-pyrrolidine-2-carboxylic acid Openeye Name: 3-(4-cyanophenyl)-1-(cyclopentanecarbonyl)-5-(3-pyridyl)-4-(thiophene-2-carbonyl)pyrrolidine-2-carboxylic acid CAS Name: 3-(4-cyanophenyl)-1-[cyclopentyl(oxo)methyl]-4-[oxo(thiophen-2-yl)methyl]-5-(3-pyridinyl)-2-pyrrolidinecarboxylic acid IUPAC Name: 3-(4-cyanophenyl)-1-(cyclopentanecarbonyl)-5-pyridin-3-yl-4-(thiophene-2-carbonyl)pyrrolidine-2-carboxylic acid Traditional Name: 3-(4-cyanophenyl)-1-(cyclopentanecarbonyl)-5-(3-pyridyl)-4-(2-thenoyl)proline Formula: C28H25N3O4S MolecularWeight: 499.5808

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)C(=O)N2C(C(C(C2C(=O)O)C3=CC=C(C=C3)C#N)C(=O)C4=CC=CS4)C5=CN=CC=C5

Isomeric SMILES

C1CCC(C1)C(=O)N2C(C(C(C2C(=O)O)C3=CC=C(C=C3)C#N)C(=O)C4=CC=CS4)C5=CN=CC=C5

InChI

InChI=1S/C28H25N3O4S/c29-15-17-9-11-18(12-10-17)22-23(26(32)21-8-4-14-36-21)24(20-7-3-13-30-16-20)31(25(22)28(34)35)27(33)19-5-1-2-6-19/h3-4,7-14,16,19,22-25H,1-2,5-6H2,(H,34,35)