2-[[(6-chloranylpyridin-3-yl)methylamino]-pentylsulfanyl-methylidene]propanedinitrile

Systemtic Name: 2-[[(6-chloranylpyridin-3-yl)methylamino]-pentylsulfanyl-methylidene]propanedinitrile Openeye Name: 2-[[(6-chloro-3-pyridyl)methylamino]-pentylsulfanyl-methylene]propanedinitrile CAS Name: 2-[[(6-chloro-3-pyridinyl)methylamino]-(pentylthio)methylidene]propanedinitrile IUPAC Name: 2-[[(6-chloropyridin-3-yl)methylamino]-pentylsulfanylmethylidene]propanedinitrile Traditional Name: 2-[(amylthio)-[(6-chloro-3-pyridyl)methylamino]methylene]malononitrile Formula: C15H17ClN4S MolecularWeight: 320.84028

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCSC(=C(C#N)C#N)NCC1=CN=C(C=C1)Cl

Isomeric SMILES

CCCCCSC(=C(C#N)C#N)NCC1=CN=C(C=C1)Cl

InChI

InChI=1S/C15H17ClN4S/c1-2-3-4-7-21-15(13(8-17)9-18)20-11-12-5-6-14(16)19-10-12/h5-6,10,20H,2-4,7,11H2,1H3