(3S,4R)-2-azanylidene-6-methyl-4-(1-methylpyridin-1-ium-3-yl)-3,4-dihydrothiopyran-3,5-dicarbonitrile

Systemtic Name: (3S,4R)-2-azanylidene-6-methyl-4-(1-methylpyridin-1-ium-3-yl)-3,4-dihydrothiopyran-3,5-dicarbonitrile Openeye Name: (3S,4R)-2-imino-6-methyl-4-(1-methylpyridin-1-ium-3-yl)-3,4-dihydrothiopyran-3,5-dicarbonitrile CAS Name: (3S,4R)-2-imino-6-methyl-4-(1-methyl-3-pyridin-1-iumyl)-3,4-dihydrothiopyran-3,5-dicarbonitrile IUPAC Name: (3S,4R)-2-imino-6-methyl-4-(1-methylpyridin-1-ium-3-yl)-3,4-dihydrothiopyran-3,5-dicarbonitrile Traditional Name: (3S,4R)-2-imino-6-methyl-4-(1-methylpyridin-1-ium-3-yl)-3,4-dihydrothiopyran-3,5-dicarbonitrile Formula: C14H13N4S+ MolecularWeight: 269.34482

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(C(=N)S1)C#N)C2=C[N+](=CC=C2)C)C#N

Isomeric SMILES

CC1=C([C@H]([C@H](C(=N)S1)C#N)C2=C[N+](=CC=C2)C)C#N

InChI

InChI=1S/C14H13N4S/c1-9-11(6-15)13(12(7-16)14(17)19-9)10-4-3-5-18(2)8-10/h3-5,8,12-13,17H,1-2H3/q+1/t12-,13-/m1/s1