2-azanyl-6-ethylsulfanyl-4-propan-2-yl-pyridin-1-ium-3,5-dicarbonitrile

Systemtic Name: 2-azanyl-6-ethylsulfanyl-4-propan-2-yl-pyridin-1-ium-3,5-dicarbonitrile Openeye Name: 2-amino-6-ethylsulfanyl-4-isopropyl-pyridin-1-ium-3,5-dicarbonitrile CAS Name: 2-amino-6-(ethylthio)-4-propan-2-ylpyridin-1-ium-3,5-dicarbonitrile IUPAC Name: 2-amino-6-ethylsulfanyl-4-propan-2-ylpyridin-1-ium-3,5-dicarbonitrile Traditional Name: 2-amino-6-(ethylthio)-4-isopropyl-pyridin-1-ium-3,5-dicarbonitrile Formula: C12H15N4S+ MolecularWeight: 247.3393

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=C(C(=C(C(=[NH+]1)N)C#N)C(C)C)C#N

Isomeric SMILES

CCSC1=C(C(=C(C(=[NH+]1)N)C#N)C(C)C)C#N

InChI

InChI=1S/C12H14N4S/c1-4-17-12-9(6-14)10(7(2)3)8(5-13)11(15)16-12/h7H,4H2,1-3H3,(H2,15,16)/p+1