2-[3-(4-methyl-3-piperidin-1-ylsulfonyl-phenyl)-6-oxidanylidene-pyridazin-1-yl]-N-phenyl-ethanamide

Systemtic Name: 2-[3-(4-methyl-3-piperidin-1-ylsulfonyl-phenyl)-6-oxidanylidene-pyridazin-1-yl]-N-phenyl-ethanamide Openeye Name: 2-[3-[4-methyl-3-(1-piperidylsulfonyl)phenyl]-6-oxo-pyridazin-1-yl]-N-phenyl-acetamide CAS Name: 2-[3-[4-methyl-3-(1-piperidinylsulfonyl)phenyl]-6-oxo-1-pyridazinyl]-N-phenylacetamide IUPAC Name: 2-[3-(4-methyl-3-piperidin-1-ylsulfonylphenyl)-6-oxopyridazin-1-yl]-N-phenylacetamide Traditional Name: 2-[6-keto-3-(4-methyl-3-piperidinosulfonyl-phenyl)pyridazin-1-yl]-N-phenyl-acetamide Formula: C24H26N4O4S MolecularWeight: 466.55264

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=NN(C(=O)C=C2)CC(=O)NC3=CC=CC=C3)S(=O)(=O)N4CCCCC4

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NN(C(=O)C=C2)CC(=O)NC3=CC=CC=C3)S(=O)(=O)N4CCCCC4

InChI

InChI=1S/C24H26N4O4S/c1-18-10-11-19(16-22(18)33(31,32)27-14-6-3-7-15-27)21-12-13-24(30)28(26-21)17-23(29)25-20-8-4-2-5-9-20/h2,4-5,8-13,16H,3,6-7,14-15,17H2,1H3,(H,25,29)