1-[(3S)-3-(4-methyl-5-methylsulfanyl-1,2,4-triazol-3-yl)piperidin-1-yl]-2-pyridin-3-yl-ethanone

Systemtic Name: 1-[(3S)-3-(4-methyl-5-methylsulfanyl-1,2,4-triazol-3-yl)piperidin-1-yl]-2-pyridin-3-yl-ethanone Openeye Name: 1-[(3S)-3-(4-methyl-5-methylsulfanyl-1,2,4-triazol-3-yl)-1-piperidyl]-2-(3-pyridyl)ethanone CAS Name: 1-[(3S)-3-[4-methyl-5-(methylthio)-1,2,4-triazol-3-yl]-1-piperidinyl]-2-(3-pyridinyl)ethanone IUPAC Name: 1-[(3S)-3-(4-methyl-5-methylsulfanyl-1,2,4-triazol-3-yl)piperidin-1-yl]-2-pyridin-3-ylethanone Traditional Name: 1-[(3S)-3-[4-methyl-5-(methylthio)-1,2,4-triazol-3-yl]piperidino]-2-(3-pyridyl)ethanone Formula: C16H21N5OS MolecularWeight: 331.43584

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SC)C2CCCN(C2)C(=O)CC3=CN=CC=C3

Isomeric SMILES

CN1C(=NN=C1SC)[C@H]2CCCN(C2)C(=O)CC3=CN=CC=C3

InChI

InChI=1S/C16H21N5OS/c1-20-15(18-19-16(20)23-2)13-6-4-8-21(11-13)14(22)9-12-5-3-7-17-10-12/h3,5,7,10,13H,4,6,8-9,11H2,1-2H3/t13-/m0/s1