2-(5-chloranyl-6-oxidanylidene-4-piperidin-1-yl-pyridazin-1-yl)sulfonylbenzenecarbonitrile

Systemtic Name: 2-(5-chloranyl-6-oxidanylidene-4-piperidin-1-yl-pyridazin-1-yl)sulfonylbenzenecarbonitrile Openeye Name: 2-[5-chloro-6-oxo-4-(1-piperidyl)pyridazin-1-yl]sulfonylbenzonitrile CAS Name: 2-[[5-chloro-6-oxo-4-(1-piperidinyl)-1-pyridazinyl]sulfonyl]benzonitrile IUPAC Name: 2-(5-chloro-6-oxo-4-piperidin-1-ylpyridazin-1-yl)sulfonylbenzonitrile Traditional Name: 2-(5-chloro-6-keto-4-piperidino-pyridazin-1-yl)sulfonylbenzonitrile Formula: C16H15ClN4O3S MolecularWeight: 378.8333

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=C(C(=O)N(N=C2)S(=O)(=O)C3=CC=CC=C3C#N)Cl

Isomeric SMILES

C1CCN(CC1)C2=C(C(=O)N(N=C2)S(=O)(=O)C3=CC=CC=C3C#N)Cl

InChI

InChI=1S/C16H15ClN4O3S/c17-15-13(20-8-4-1-5-9-20)11-19-21(16(15)22)25(23,24)14-7-3-2-6-12(14)10-18/h2-3,6-7,11H,1,4-5,8-9H2