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

Systemtic Name: N-(4-chlorophenyl)-2-[4-methyl-3-(1-methylsulfonylpiperidin-4-yl)-5-oxidanylidene-1,2,4-triazol-1-yl]ethanamide Openeye Name: N-(4-chlorophenyl)-2-[4-methyl-3-(1-methylsulfonyl-4-piperidyl)-5-oxo-1,2,4-triazol-1-yl]acetamide CAS Name: N-(4-chlorophenyl)-2-[4-methyl-3-(1-methylsulfonyl-4-piperidinyl)-5-oxo-1,2,4-triazol-1-yl]acetamide IUPAC Name: N-(4-chlorophenyl)-2-[4-methyl-3-(1-methylsulfonylpiperidin-4-yl)-5-oxo-1,2,4-triazol-1-yl]acetamide Traditional Name: N-(4-chlorophenyl)-2-[5-keto-3-(1-mesyl-4-piperidyl)-4-methyl-1,2,4-triazol-1-yl]acetamide Formula: C17H22ClN5O4S MolecularWeight: 427.90568

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN(C1=O)CC(=O)NC2=CC=C(C=C2)Cl)C3CCN(CC3)S(=O)(=O)C

Isomeric SMILES

CN1C(=NN(C1=O)CC(=O)NC2=CC=C(C=C2)Cl)C3CCN(CC3)S(=O)(=O)C

InChI

InChI=1S/C17H22ClN5O4S/c1-21-16(12-7-9-22(10-8-12)28(2,26)27)20-23(17(21)25)11-15(24)19-14-5-3-13(18)4-6-14/h3-6,12H,7-11H2,1-2H3,(H,19,24)