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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC(=O)CN2C(=O)N(C(=N2)C3CCN(CC3)S(=O)(=O)C)C

Isomeric SMILES

CC1=CC=C(C=C1)CNC(=O)CN2C(=O)N(C(=N2)C3CCN(CC3)S(=O)(=O)C)C

InChI

InChI=1S/C19H27N5O4S/c1-14-4-6-15(7-5-14)12-20-17(25)13-24-19(26)22(2)18(21-24)16-8-10-23(11-9-16)29(3,27)28/h4-7,16H,8-13H2,1-3H3,(H,20,25)