6-methyl-N-(1-methylsulfonylpiperidin-4-yl)-1-(2-nitrophenyl)-4-oxidanylidene-pyridazine-3-carboxamide

Systemtic Name: 6-methyl-N-(1-methylsulfonylpiperidin-4-yl)-1-(2-nitrophenyl)-4-oxidanylidene-pyridazine-3-carboxamide Openeye Name: 6-methyl-N-(1-methylsulfonyl-4-piperidyl)-1-(2-nitrophenyl)-4-oxo-pyridazine-3-carboxamide CAS Name: 6-methyl-N-(1-methylsulfonyl-4-piperidinyl)-1-(2-nitrophenyl)-4-oxo-3-pyridazinecarboxamide IUPAC Name: 6-methyl-N-(1-methylsulfonylpiperidin-4-yl)-1-(2-nitrophenyl)-4-oxopyridazine-3-carboxamide Traditional Name: 4-keto-N-(1-mesyl-4-piperidyl)-6-methyl-1-(2-nitrophenyl)pyridazine-3-carboxamide Formula: C18H21N5O6S MolecularWeight: 435.45424

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)C(=NN1C2=CC=CC=C2[N+](=O)[O-])C(=O)NC3CCN(CC3)S(=O)(=O)C

Isomeric SMILES

CC1=CC(=O)C(=NN1C2=CC=CC=C2[N+](=O)[O-])C(=O)NC3CCN(CC3)S(=O)(=O)C

InChI

InChI=1S/C18H21N5O6S/c1-12-11-16(24)17(20-22(12)14-5-3-4-6-15(14)23(26)27)18(25)19-13-7-9-21(10-8-13)30(2,28)29/h3-6,11,13H,7-10H2,1-2H3,(H,19,25)