1-methylsulfonyl-N-[4-(6-piperidin-1-ylpyridazin-3-yl)phenyl]piperidine-4-carboxamide

Systemtic Name: 1-methylsulfonyl-N-[4-(6-piperidin-1-ylpyridazin-3-yl)phenyl]piperidine-4-carboxamide Openeye Name: 1-methylsulfonyl-N-[4-[6-(1-piperidyl)pyridazin-3-yl]phenyl]piperidine-4-carboxamide CAS Name: 1-methylsulfonyl-N-[4-[6-(1-piperidinyl)-3-pyridazinyl]phenyl]-4-piperidinecarboxamide IUPAC Name: 1-methylsulfonyl-N-[4-(6-piperidin-1-ylpyridazin-3-yl)phenyl]piperidine-4-carboxamide Traditional Name: 1-mesyl-N-[4-(6-piperidinopyridazin-3-yl)phenyl]isonipecotamide Formula: C22H29N5O3S MolecularWeight: 443.56236

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCC(CC1)C(=O)NC2=CC=C(C=C2)C3=NN=C(C=C3)N4CCCCC4

Isomeric SMILES

CS(=O)(=O)N1CCC(CC1)C(=O)NC2=CC=C(C=C2)C3=NN=C(C=C3)N4CCCCC4

InChI

InChI=1S/C22H29N5O3S/c1-31(29,30)27-15-11-18(12-16-27)22(28)23-19-7-5-17(6-8-19)20-9-10-21(25-24-20)26-13-3-2-4-14-26/h5-10,18H,2-4,11-16H2,1H3,(H,23,28)