2-[2-[(5-chloranyl-6-oxidanylidene-1H-pyridazin-4-yl)amino]ethylsulfanylmethyl]benzenecarbonitrile

Systemtic Name: 2-[2-[(5-chloranyl-6-oxidanylidene-1H-pyridazin-4-yl)amino]ethylsulfanylmethyl]benzenecarbonitrile Openeye Name: 2-[2-[(5-chloro-6-oxo-1H-pyridazin-4-yl)amino]ethylsulfanylmethyl]benzonitrile CAS Name: 2-[[2-[(5-chloro-6-oxo-1H-pyridazin-4-yl)amino]ethylthio]methyl]benzonitrile IUPAC Name: 2-[2-[(5-chloro-6-oxo-1H-pyridazin-4-yl)amino]ethylsulfanylmethyl]benzonitrile Traditional Name: 2-[[2-[(5-chloro-6-keto-1H-pyridazin-4-yl)amino]ethylthio]methyl]benzonitrile Formula: C14H13ClN4OS MolecularWeight: 320.79722

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CSCCNC2=C(C(=O)NN=C2)Cl)C#N

Isomeric SMILES

C1=CC=C(C(=C1)CSCCNC2=C(C(=O)NN=C2)Cl)C#N

InChI

InChI=1S/C14H13ClN4OS/c15-13-12(8-18-19-14(13)20)17-5-6-21-9-11-4-2-1-3-10(11)7-16/h1-4,8H,5-6,9H2,(H2,17,19,20)