N-[4-(pyridin-3-ylmethylsulfanyl)phenyl]-2,3-dihydro-1H-indene-5-sulfonamide

Systemtic Name: N-[4-(pyridin-3-ylmethylsulfanyl)phenyl]-2,3-dihydro-1H-indene-5-sulfonamide Openeye Name: N-[4-(3-pyridylmethylsulfanyl)phenyl]indane-5-sulfonamide CAS Name: N-[4-(3-pyridinylmethylthio)phenyl]-2,3-dihydro-1H-indene-5-sulfonamide IUPAC Name: N-[4-(pyridin-3-ylmethylsulfanyl)phenyl]-2,3-dihydro-1H-indene-5-sulfonamide Traditional Name: N-[4-(3-pyridylmethylthio)phenyl]indane-5-sulfonamide Formula: C21H20N2O2S2 MolecularWeight: 396.5257

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C1)C=C(C=C2)S(=O)(=O)NC3=CC=C(C=C3)SCC4=CN=CC=C4

Isomeric SMILES

C1CC2=C(C1)C=C(C=C2)S(=O)(=O)NC3=CC=C(C=C3)SCC4=CN=CC=C4

InChI

InChI=1S/C21H20N2O2S2/c24-27(25,21-11-6-17-4-1-5-18(17)13-21)23-19-7-9-20(10-8-19)26-15-16-3-2-12-22-14-16/h2-3,6-14,23H,1,4-5,15H2