1-methyl-4-[2-oxidanylidene-2-(4-piperidin-1-ylpiperidin-1-yl)ethyl]sulfanyl-quinolin-2-one

Systemtic Name: 1-methyl-4-[2-oxidanylidene-2-(4-piperidin-1-ylpiperidin-1-yl)ethyl]sulfanyl-quinolin-2-one Openeye Name: 1-methyl-4-[2-oxo-2-[4-(1-piperidyl)-1-piperidyl]ethyl]sulfanyl-quinolin-2-one CAS Name: 1-methyl-4-[[2-oxo-2-[4-(1-piperidinyl)-1-piperidinyl]ethyl]thio]-2-quinolinone IUPAC Name: 1-methyl-4-[2-oxo-2-(4-piperidin-1-ylpiperidin-1-yl)ethyl]sulfanylquinolin-2-one Traditional Name: 4-[[2-keto-2-(4-piperidinopiperidino)ethyl]thio]-1-methyl-carbostyril Formula: C22H29N3O2S MolecularWeight: 399.54956

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2C(=CC1=O)SCC(=O)N3CCC(CC3)N4CCCCC4

Isomeric SMILES

CN1C2=CC=CC=C2C(=CC1=O)SCC(=O)N3CCC(CC3)N4CCCCC4

InChI

InChI=1S/C22H29N3O2S/c1-23-19-8-4-3-7-18(19)20(15-21(23)26)28-16-22(27)25-13-9-17(10-14-25)24-11-5-2-6-12-24/h3-4,7-8,15,17H,2,5-6,9-14,16H2,1H3