N-cyclopropyl-2-[2-(2,6-dimethylpiperidin-1-yl)-2-oxidanylidene-ethyl]sulfanyl-quinoline-4-carboxamide

Systemtic Name: N-cyclopropyl-2-[2-(2,6-dimethylpiperidin-1-yl)-2-oxidanylidene-ethyl]sulfanyl-quinoline-4-carboxamide Openeye Name: N-cyclopropyl-2-[2-(2,6-dimethyl-1-piperidyl)-2-oxo-ethyl]sulfanyl-quinoline-4-carboxamide CAS Name: N-cyclopropyl-2-[[2-(2,6-dimethyl-1-piperidinyl)-2-oxoethyl]thio]-4-quinolinecarboxamide IUPAC Name: N-cyclopropyl-2-[2-(2,6-dimethylpiperidin-1-yl)-2-oxoethyl]sulfanylquinoline-4-carboxamide Traditional Name: N-cyclopropyl-2-[[2-(2,6-dimethylpiperidino)-2-keto-ethyl]thio]cinchoninamide Formula: C22H27N3O2S MolecularWeight: 397.53368

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(N1C(=O)CSC2=NC3=CC=CC=C3C(=C2)C(=O)NC4CC4)C

Isomeric SMILES

CC1CCCC(N1C(=O)CSC2=NC3=CC=CC=C3C(=C2)C(=O)NC4CC4)C

InChI

InChI=1S/C22H27N3O2S/c1-14-6-5-7-15(2)25(14)21(26)13-28-20-12-18(22(27)23-16-10-11-16)17-8-3-4-9-19(17)24-20/h3-4,8-9,12,14-16H,5-7,10-11,13H2,1-2H3,(H,23,27)