3-[[4-ethyl-5-[(3S)-1-methylsulfonylpiperidin-3-yl]-1,2,4-triazol-3-yl]sulfanylmethyl]pyridine

Systemtic Name: 3-[[4-ethyl-5-[(3S)-1-methylsulfonylpiperidin-3-yl]-1,2,4-triazol-3-yl]sulfanylmethyl]pyridine Openeye Name: 3-[[4-ethyl-5-[(3S)-1-methylsulfonyl-3-piperidyl]-1,2,4-triazol-3-yl]sulfanylmethyl]pyridine CAS Name: 3-[[[4-ethyl-5-[(3S)-1-methylsulfonyl-3-piperidinyl]-1,2,4-triazol-3-yl]thio]methyl]pyridine IUPAC Name: 3-[[4-ethyl-5-[(3S)-1-methylsulfonylpiperidin-3-yl]-1,2,4-triazol-3-yl]sulfanylmethyl]pyridine Traditional Name: 3-[[[4-ethyl-5-[(3S)-1-mesyl-3-piperidyl]-1,2,4-triazol-3-yl]thio]methyl]pyridine Formula: C16H23N5O2S2 MolecularWeight: 381.51612

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC2=CN=CC=C2)C3CCCN(C3)S(=O)(=O)C

Isomeric SMILES

CCN1C(=NN=C1SCC2=CN=CC=C2)[C@H]3CCCN(C3)S(=O)(=O)C

InChI

InChI=1S/C16H23N5O2S2/c1-3-21-15(14-7-5-9-20(11-14)25(2,22)23)18-19-16(21)24-12-13-6-4-8-17-10-13/h4,6,8,10,14H,3,5,7,9,11-12H2,1-2H3/t14-/m0/s1