N-(4-methyl-3-piperidin-1-ylsulfonyl-phenyl)-6-oxidanylidene-1-propyl-pyridazine-3-carboxamide

Systemtic Name: N-(4-methyl-3-piperidin-1-ylsulfonyl-phenyl)-6-oxidanylidene-1-propyl-pyridazine-3-carboxamide Openeye Name: N-[4-methyl-3-(1-piperidylsulfonyl)phenyl]-6-oxo-1-propyl-pyridazine-3-carboxamide CAS Name: N-[4-methyl-3-(1-piperidinylsulfonyl)phenyl]-6-oxo-1-propyl-3-pyridazinecarboxamide IUPAC Name: N-(4-methyl-3-piperidin-1-ylsulfonylphenyl)-6-oxo-1-propylpyridazine-3-carboxamide Traditional Name: 6-keto-N-(4-methyl-3-piperidinosulfonyl-phenyl)-1-propyl-pyridazine-3-carboxamide Formula: C20H26N4O4S MolecularWeight: 418.50984

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C=CC(=N1)C(=O)NC2=CC(=C(C=C2)C)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CCCN1C(=O)C=CC(=N1)C(=O)NC2=CC(=C(C=C2)C)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C20H26N4O4S/c1-3-11-24-19(25)10-9-17(22-24)20(26)21-16-8-7-15(2)18(14-16)29(27,28)23-12-5-4-6-13-23/h7-10,14H,3-6,11-13H2,1-2H3,(H,21,26)