1-[(2S)-2-ethylpiperidin-1-yl]-2-(5-morpholin-4-ylsulfonylpyridin-2-yl)sulfanyl-ethanone

Systemtic Name: 1-[(2S)-2-ethylpiperidin-1-yl]-2-(5-morpholin-4-ylsulfonylpyridin-2-yl)sulfanyl-ethanone Openeye Name: 1-[(2S)-2-ethyl-1-piperidyl]-2-[(5-morpholinosulfonyl-2-pyridyl)sulfanyl]ethanone CAS Name: 1-[(2S)-2-ethyl-1-piperidinyl]-2-[[5-(4-morpholinylsulfonyl)-2-pyridinyl]thio]ethanone IUPAC Name: 1-[(2S)-2-ethylpiperidin-1-yl]-2-(5-morpholin-4-ylsulfonylpyridin-2-yl)sulfanylethanone Traditional Name: 1-[(2S)-2-ethylpiperidino]-2-[(5-morpholinosulfonyl-2-pyridyl)thio]ethanone Formula: C18H27N3O4S2 MolecularWeight: 413.55468

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1CCCCN1C(=O)CSC2=NC=C(C=C2)S(=O)(=O)N3CCOCC3

Isomeric SMILES

CC[C@H]1CCCCN1C(=O)CSC2=NC=C(C=C2)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C18H27N3O4S2/c1-2-15-5-3-4-8-21(15)18(22)14-26-17-7-6-16(13-19-17)27(23,24)20-9-11-25-12-10-20/h6-7,13,15H,2-5,8-12,14H2,1H3/t15-/m0/s1