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

Systemtic Name: 3-(4-cyanophenyl)-1-(phenylcarbonyl)-5-pyridin-3-yl-4-thiophen-2-ylcarbonyl-pyrrolidine-2-carboxylic acid Openeye Name: 1-benzoyl-3-(4-cyanophenyl)-5-(3-pyridyl)-4-(thiophene-2-carbonyl)pyrrolidine-2-carboxylic acid CAS Name: 1-benzoyl-3-(4-cyanophenyl)-4-[oxo(thiophen-2-yl)methyl]-5-(3-pyridinyl)-2-pyrrolidinecarboxylic acid IUPAC Name: 1-benzoyl-3-(4-cyanophenyl)-5-pyridin-3-yl-4-(thiophene-2-carbonyl)pyrrolidine-2-carboxylic acid Traditional Name: 1-benzoyl-3-(4-cyanophenyl)-5-(3-pyridyl)-4-(2-thenoyl)proline Formula: C29H21N3O4S MolecularWeight: 507.55974

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=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

C1=CC=C(C=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/C29H21N3O4S/c30-16-18-10-12-19(13-11-18)23-24(27(33)22-9-5-15-37-22)25(21-8-4-14-31-17-21)32(26(23)29(35)36)28(34)20-6-2-1-3-7-20/h1-15,17,23-26H,(H,35,36)