1-(2-ethylpiperidin-1-yl)-2-(5-pyrrolidin-1-ylsulfonylpyridin-2-yl)sulfanyl-propan-1-one

Systemtic Name: 1-(2-ethylpiperidin-1-yl)-2-(5-pyrrolidin-1-ylsulfonylpyridin-2-yl)sulfanyl-propan-1-one Openeye Name: 1-(2-ethyl-1-piperidyl)-2-[(5-pyrrolidin-1-ylsulfonyl-2-pyridyl)sulfanyl]propan-1-one CAS Name: 1-(2-ethyl-1-piperidinyl)-2-[[5-(1-pyrrolidinylsulfonyl)-2-pyridinyl]thio]-1-propanone IUPAC Name: 1-(2-ethylpiperidin-1-yl)-2-(5-pyrrolidin-1-ylsulfonylpyridin-2-yl)sulfanylpropan-1-one Traditional Name: 1-(2-ethylpiperidino)-2-[(5-pyrrolidinosulfonyl-2-pyridyl)thio]propan-1-one Formula: C19H29N3O3S2 MolecularWeight: 411.58186

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1CCCCN1C(=O)C(C)SC2=NC=C(C=C2)S(=O)(=O)N3CCCC3

Isomeric SMILES

CCC1CCCCN1C(=O)C(C)SC2=NC=C(C=C2)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C19H29N3O3S2/c1-3-16-8-4-5-13-22(16)19(23)15(2)26-18-10-9-17(14-20-18)27(24,25)21-11-6-7-12-21/h9-10,14-16H,3-8,11-13H2,1-2H3