2-[3,4-bis(methylsulfonyl)phenyl]-3-cyclopentyl-N-pyridin-2-yl-propanamide

Systemtic Name: 2-[3,4-bis(methylsulfonyl)phenyl]-3-cyclopentyl-N-pyridin-2-yl-propanamide Openeye Name: 2-[3,4-bis(methylsulfonyl)phenyl]-3-cyclopentyl-N-(2-pyridyl)propanamide CAS Name: 2-[3,4-bis(methylsulfonyl)phenyl]-3-cyclopentyl-N-(2-pyridinyl)propanamide IUPAC Name: 2-[3,4-bis(methylsulfonyl)phenyl]-3-cyclopentyl-N-pyridin-2-ylpropanamide Traditional Name: 3-cyclopentyl-2-(3,4-dimesylphenyl)-N-(2-pyridyl)propionamide Formula: C21H26N2O5S2 MolecularWeight: 450.57154

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=C(C=C(C=C1)C(CC2CCCC2)C(=O)NC3=CC=CC=N3)S(=O)(=O)C

Isomeric SMILES

CS(=O)(=O)C1=C(C=C(C=C1)C(CC2CCCC2)C(=O)NC3=CC=CC=N3)S(=O)(=O)C

InChI

InChI=1S/C21H26N2O5S2/c1-29(25,26)18-11-10-16(14-19(18)30(2,27)28)17(13-15-7-3-4-8-15)21(24)23-20-9-5-6-12-22-20/h5-6,9-12,14-15,17H,3-4,7-8,13H2,1-2H3,(H,22,23,24)