2-[4-methyl-3-(1-methylsulfonylpiperidin-3-yl)-5-oxidanylidene-1,2,4-triazol-1-yl]-N-[(4-methylphenyl)methyl]ethanamide

Systemtic Name: 2-[4-methyl-3-(1-methylsulfonylpiperidin-3-yl)-5-oxidanylidene-1,2,4-triazol-1-yl]-N-[(4-methylphenyl)methyl]ethanamide Openeye Name: 2-[4-methyl-3-(1-methylsulfonyl-3-piperidyl)-5-oxo-1,2,4-triazol-1-yl]-N-(p-tolylmethyl)acetamide CAS Name: 2-[4-methyl-3-(1-methylsulfonyl-3-piperidinyl)-5-oxo-1,2,4-triazol-1-yl]-N-[(4-methylphenyl)methyl]acetamide IUPAC Name: 2-[4-methyl-3-(1-methylsulfonylpiperidin-3-yl)-5-oxo-1,2,4-triazol-1-yl]-N-[(4-methylphenyl)methyl]acetamide Traditional Name: 2-[5-keto-3-(1-mesyl-3-piperidyl)-4-methyl-1,2,4-triazol-1-yl]-N-(4-methylbenzyl)acetamide Formula: C19H27N5O4S MolecularWeight: 421.51378

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC(=O)CN2C(=O)N(C(=N2)C3CCCN(C3)S(=O)(=O)C)C

Isomeric SMILES

CC1=CC=C(C=C1)CNC(=O)CN2C(=O)N(C(=N2)C3CCCN(C3)S(=O)(=O)C)C

InChI

InChI=1S/C19H27N5O4S/c1-14-6-8-15(9-7-14)11-20-17(25)13-24-19(26)22(2)18(21-24)16-5-4-10-23(12-16)29(3,27)28/h6-9,16H,4-5,10-13H2,1-3H3,(H,20,25)