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

Systemtic Name: (E)-2-(2-methylpyridin-1-ium-1-yl)-3-phenylazanyl-3-sulfanyl-prop-2-enenitrile Openeye Name: (E)-3-anilino-2-(2-methylpyridin-1-ium-1-yl)-3-sulfanyl-prop-2-enenitrile CAS Name: (E)-3-anilino-3-mercapto-2-(2-methyl-1-pyridin-1-iumyl)-2-propenenitrile IUPAC Name: (E)-3-anilino-2-(2-methylpyridin-1-ium-1-yl)-3-sulfanylprop-2-enenitrile Traditional Name: (E)-3-anilino-3-mercapto-2-(2-methylpyridin-1-ium-1-yl)acrylonitrile Formula: C15H14N3S+ MolecularWeight: 268.35676

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=[N+]1C(=C(NC2=CC=CC=C2)S)C#N

Isomeric SMILES

CC1=CC=CC=[N+]1/C(=C(\NC2=CC=CC=C2)/S)/C#N

InChI

InChI=1S/C15H13N3S/c1-12-7-5-6-10-18(12)14(11-16)15(19)17-13-8-3-2-4-9-13/h2-10,17H,1H3/p+1/b15-14+