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

Systemtic Name: N-(2,3-dimethylphenyl)-2-[4-methyl-3-(1-methylsulfonylpiperidin-4-yl)-5-oxidanylidene-1,2,4-triazol-1-yl]ethanamide Openeye Name: N-(2,3-dimethylphenyl)-2-[4-methyl-3-(1-methylsulfonyl-4-piperidyl)-5-oxo-1,2,4-triazol-1-yl]acetamide CAS Name: N-(2,3-dimethylphenyl)-2-[4-methyl-3-(1-methylsulfonyl-4-piperidinyl)-5-oxo-1,2,4-triazol-1-yl]acetamide IUPAC Name: N-(2,3-dimethylphenyl)-2-[4-methyl-3-(1-methylsulfonylpiperidin-4-yl)-5-oxo-1,2,4-triazol-1-yl]acetamide Traditional Name: N-(2,3-dimethylphenyl)-2-[5-keto-3-(1-mesyl-4-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=C(C(=CC=C1)NC(=O)CN2C(=O)N(C(=N2)C3CCN(CC3)S(=O)(=O)C)C)C

Isomeric SMILES

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

InChI

InChI=1S/C19H27N5O4S/c1-13-6-5-7-16(14(13)2)20-17(25)12-24-19(26)22(3)18(21-24)15-8-10-23(11-9-15)29(4,27)28/h5-7,15H,8-12H2,1-4H3,(H,20,25)