N-[2-(6-oxidanylidene-3-thiophen-2-yl-pyridazin-1-yl)ethyl]-4-piperidin-1-ylsulfonyl-benzamide

Systemtic Name: N-[2-(6-oxidanylidene-3-thiophen-2-yl-pyridazin-1-yl)ethyl]-4-piperidin-1-ylsulfonyl-benzamide Openeye Name: N-[2-[6-oxo-3-(2-thienyl)pyridazin-1-yl]ethyl]-4-(1-piperidylsulfonyl)benzamide CAS Name: N-[2-(6-oxo-3-thiophen-2-yl-1-pyridazinyl)ethyl]-4-(1-piperidinylsulfonyl)benzamide IUPAC Name: N-[2-(6-oxo-3-thiophen-2-ylpyridazin-1-yl)ethyl]-4-piperidin-1-ylsulfonylbenzamide Traditional Name: N-[2-[6-keto-3-(2-thienyl)pyridazin-1-yl]ethyl]-4-piperidinosulfonyl-benzamide Formula: C22H24N4O4S2 MolecularWeight: 472.58036

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NCCN3C(=O)C=CC(=N3)C4=CC=CS4

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NCCN3C(=O)C=CC(=N3)C4=CC=CS4

InChI

InChI=1S/C22H24N4O4S2/c27-21-11-10-19(20-5-4-16-31-20)24-26(21)15-12-23-22(28)17-6-8-18(9-7-17)32(29,30)25-13-2-1-3-14-25/h4-11,16H,1-3,12-15H2,(H,23,28)