2-azanyl-4-(4-methylphenyl)-6-propylsulfanyl-pyridin-1-ium-3,5-dicarbonitrile

Systemtic Name: 2-azanyl-4-(4-methylphenyl)-6-propylsulfanyl-pyridin-1-ium-3,5-dicarbonitrile Openeye Name: 2-amino-6-propylsulfanyl-4-(p-tolyl)pyridin-1-ium-3,5-dicarbonitrile CAS Name: 2-amino-4-(4-methylphenyl)-6-(propylthio)pyridin-1-ium-3,5-dicarbonitrile IUPAC Name: 2-amino-4-(4-methylphenyl)-6-propylsulfanylpyridin-1-ium-3,5-dicarbonitrile Traditional Name: 2-amino-6-(propylthio)-4-(p-tolyl)pyridin-1-ium-3,5-dicarbonitrile Formula: C17H17N4S+ MolecularWeight: 309.40868

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=C(C(=C(C(=[NH+]1)N)C#N)C2=CC=C(C=C2)C)C#N

Isomeric SMILES

CCCSC1=C(C(=C(C(=[NH+]1)N)C#N)C2=CC=C(C=C2)C)C#N

InChI

InChI=1S/C17H16N4S/c1-3-8-22-17-14(10-19)15(13(9-18)16(20)21-17)12-6-4-11(2)5-7-12/h4-7H,3,8H2,1-2H3,(H2,20,21)/p+1