2-[(prop-2-enylamino)-(pyridin-2-ylmethylsulfanyl)methylidene]propanedinitrile

Systemtic Name: 2-[(prop-2-enylamino)-(pyridin-2-ylmethylsulfanyl)methylidene]propanedinitrile Openeye Name: 2-[(allylamino)-(2-pyridylmethylsulfanyl)methylene]propanedinitrile CAS Name: 2-[(prop-2-enylamino)-(2-pyridinylmethylthio)methylidene]propanedinitrile IUPAC Name: 2-[(prop-2-enylamino)-(pyridin-2-ylmethylsulfanyl)methylidene]propanedinitrile Traditional Name: 2-[(allylamino)-(2-pyridylmethylthio)methylene]malononitrile Formula: C13H12N4S MolecularWeight: 256.32618

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC(=C(C#N)C#N)SCC1=CC=CC=N1

Isomeric SMILES

C=CCNC(=C(C#N)C#N)SCC1=CC=CC=N1

InChI

InChI=1S/C13H12N4S/c1-2-6-17-13(11(8-14)9-15)18-10-12-5-3-4-7-16-12/h2-5,7,17H,1,6,10H2