1-(2,3-dihydro-1H-inden-5-yl)-2-(5-piperidin-1-ylsulfonylpyridin-2-yl)sulfanyl-propan-1-one

Systemtic Name: 1-(2,3-dihydro-1H-inden-5-yl)-2-(5-piperidin-1-ylsulfonylpyridin-2-yl)sulfanyl-propan-1-one Openeye Name: 1-indan-5-yl-2-[[5-(1-piperidylsulfonyl)-2-pyridyl]sulfanyl]propan-1-one CAS Name: 1-(2,3-dihydro-1H-inden-5-yl)-2-[[5-(1-piperidinylsulfonyl)-2-pyridinyl]thio]-1-propanone IUPAC Name: 1-(2,3-dihydro-1H-inden-5-yl)-2-(5-piperidin-1-ylsulfonylpyridin-2-yl)sulfanylpropan-1-one Traditional Name: 1-indan-5-yl-2-[(5-piperidinosulfonyl-2-pyridyl)thio]propan-1-one Formula: C22H26N2O3S2 MolecularWeight: 430.58344

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C1=CC2=C(CCC2)C=C1)SC3=NC=C(C=C3)S(=O)(=O)N4CCCCC4

Isomeric SMILES

CC(C(=O)C1=CC2=C(CCC2)C=C1)SC3=NC=C(C=C3)S(=O)(=O)N4CCCCC4

InChI

InChI=1S/C22H26N2O3S2/c1-16(22(25)19-9-8-17-6-5-7-18(17)14-19)28-21-11-10-20(15-23-21)29(26,27)24-12-3-2-4-13-24/h8-11,14-16H,2-7,12-13H2,1H3