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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H27N5O4S/c1-13-7-8-14(2)16(10-13)20-17(25)12-24-19(26)22(3)18(21-24)15-6-5-9-23(11-15)29(4,27)28/h7-8,10,15H,5-6,9,11-12H2,1-4H3,(H,20,25)