2-azanyl-4-phenyl-6-propylsulfanyl-pyridin-1-ium-3,5-dicarbonitrile

Systemtic Name: 2-azanyl-4-phenyl-6-propylsulfanyl-pyridin-1-ium-3,5-dicarbonitrile Openeye Name: 2-amino-4-phenyl-6-propylsulfanyl-pyridin-1-ium-3,5-dicarbonitrile CAS Name: 2-amino-4-phenyl-6-(propylthio)pyridin-1-ium-3,5-dicarbonitrile IUPAC Name: 2-amino-4-phenyl-6-propylsulfanylpyridin-1-ium-3,5-dicarbonitrile Traditional Name: 2-amino-4-phenyl-6-(propylthio)pyridin-1-ium-3,5-dicarbonitrile Formula: C16H15N4S+ MolecularWeight: 295.3821

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H14N4S/c1-2-8-21-16-13(10-18)14(11-6-4-3-5-7-11)12(9-17)15(19)20-16/h3-7H,2,8H2,1H3,(H2,19,20)/p+1