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

Systemtic Name: 2-[4-methyl-3-(1-methylsulfonylpiperidin-3-yl)-5-oxidanylidene-1,2,4-triazol-1-yl]-N-(4-methylphenyl)ethanamide Openeye Name: 2-[4-methyl-3-(1-methylsulfonyl-3-piperidyl)-5-oxo-1,2,4-triazol-1-yl]-N-(p-tolyl)acetamide CAS Name: 2-[4-methyl-3-(1-methylsulfonyl-3-piperidinyl)-5-oxo-1,2,4-triazol-1-yl]-N-(4-methylphenyl)acetamide IUPAC Name: 2-[4-methyl-3-(1-methylsulfonylpiperidin-3-yl)-5-oxo-1,2,4-triazol-1-yl]-N-(4-methylphenyl)acetamide Traditional Name: 2-[5-keto-3-(1-mesyl-3-piperidyl)-4-methyl-1,2,4-triazol-1-yl]-N-(p-tolyl)acetamide Formula: C18H25N5O4S MolecularWeight: 407.4872

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H25N5O4S/c1-13-6-8-15(9-7-13)19-16(24)12-23-18(25)21(2)17(20-23)14-5-4-10-22(11-14)28(3,26)27/h6-9,14H,4-5,10-12H2,1-3H3,(H,19,24)