4-[4-(5-chloranyl-6-oxidanylidene-1H-pyridazin-4-yl)piperazin-1-yl]sulfonylbenzenecarbonitrile

Systemtic Name: 4-[4-(5-chloranyl-6-oxidanylidene-1H-pyridazin-4-yl)piperazin-1-yl]sulfonylbenzenecarbonitrile Openeye Name: 4-[4-(5-chloro-6-oxo-1H-pyridazin-4-yl)piperazin-1-yl]sulfonylbenzonitrile CAS Name: 4-[[4-(5-chloro-6-oxo-1H-pyridazin-4-yl)-1-piperazinyl]sulfonyl]benzonitrile IUPAC Name: 4-[4-(5-chloro-6-oxo-1H-pyridazin-4-yl)piperazin-1-yl]sulfonylbenzonitrile Traditional Name: 4-[4-(5-chloro-6-keto-1H-pyridazin-4-yl)piperazino]sulfonylbenzonitrile Formula: C15H14ClN5O3S MolecularWeight: 379.82136

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C(=O)NN=C2)Cl)S(=O)(=O)C3=CC=C(C=C3)C#N

Isomeric SMILES

C1CN(CCN1C2=C(C(=O)NN=C2)Cl)S(=O)(=O)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C15H14ClN5O3S/c16-14-13(10-18-19-15(14)22)20-5-7-21(8-6-20)25(23,24)12-3-1-11(9-17)2-4-12/h1-4,10H,5-8H2,(H,19,22)