(E)-3-ethylsulfanyl-2-(4-methylpyridin-1-ium-1-yl)-3-sulfanyl-prop-2-enenitrile

Systemtic Name: (E)-3-ethylsulfanyl-2-(4-methylpyridin-1-ium-1-yl)-3-sulfanyl-prop-2-enenitrile Openeye Name: (E)-3-ethylsulfanyl-2-(4-methylpyridin-1-ium-1-yl)-3-sulfanyl-prop-2-enenitrile CAS Name: (E)-3-(ethylthio)-3-mercapto-2-(4-methyl-1-pyridin-1-iumyl)-2-propenenitrile IUPAC Name: (E)-3-ethylsulfanyl-2-(4-methylpyridin-1-ium-1-yl)-3-sulfanylprop-2-enenitrile Traditional Name: (E)-3-(ethylthio)-3-mercapto-2-(4-methylpyridin-1-ium-1-yl)acrylonitrile Formula: C11H13N2S2+ MolecularWeight: 237.36432

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Descriptors Computed from Structure

Canonical SMILES:

CCSC(=C(C#N)[N+]1=CC=C(C=C1)C)S

Isomeric SMILES

CCS/C(=C(\C#N)/[N+]1=CC=C(C=C1)C)/S

InChI

InChI=1S/C11H12N2S2/c1-3-15-11(14)10(8-12)13-6-4-9(2)5-7-13/h4-7H,3H2,1-2H3/p+1/b11-10+