2-[5-chloranyl-4-(cyclohexylamino)-6-oxidanylidene-pyridazin-1-yl]sulfonylbenzenecarbonitrile

Systemtic Name: 2-[5-chloranyl-4-(cyclohexylamino)-6-oxidanylidene-pyridazin-1-yl]sulfonylbenzenecarbonitrile Openeye Name: 2-[5-chloro-4-(cyclohexylamino)-6-oxo-pyridazin-1-yl]sulfonylbenzonitrile CAS Name: 2-[[5-chloro-4-(cyclohexylamino)-6-oxo-1-pyridazinyl]sulfonyl]benzonitrile IUPAC Name: 2-[5-chloro-4-(cyclohexylamino)-6-oxopyridazin-1-yl]sulfonylbenzonitrile Traditional Name: 2-[5-chloro-4-(cyclohexylamino)-6-keto-pyridazin-1-yl]sulfonylbenzonitrile Formula: C17H17ClN4O3S MolecularWeight: 392.85988

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC2=C(C(=O)N(N=C2)S(=O)(=O)C3=CC=CC=C3C#N)Cl

Isomeric SMILES

C1CCC(CC1)NC2=C(C(=O)N(N=C2)S(=O)(=O)C3=CC=CC=C3C#N)Cl

InChI

InChI=1S/C17H17ClN4O3S/c18-16-14(21-13-7-2-1-3-8-13)11-20-22(17(16)23)26(24,25)15-9-5-4-6-12(15)10-19/h4-6,9,11,13,21H,1-3,7-8H2