2-[4-[(E)-2-(1-benzothiophen-3-yl)ethenyl]-2-(4-methylpyridin-2-yl)pyridin-1-ium-1-yl]ethanamine

Systemtic Name: 2-[4-[(E)-2-(1-benzothiophen-3-yl)ethenyl]-2-(4-methylpyridin-2-yl)pyridin-1-ium-1-yl]ethanamine Openeye Name: 2-[4-[(E)-2-(benzothiophen-3-yl)vinyl]-2-(4-methyl-2-pyridyl)pyridin-1-ium-1-yl]ethanamine CAS Name: 2-[4-[(E)-2-(1-benzothiophen-3-yl)ethenyl]-2-(4-methyl-2-pyridinyl)-1-pyridin-1-iumyl]ethanamine IUPAC Name: 2-[4-[(E)-2-(1-benzothiophen-3-yl)ethenyl]-2-(4-methylpyridin-2-yl)pyridin-1-ium-1-yl]ethanamine Traditional Name: 2-[4-[(E)-2-(benzothiophen-3-yl)vinyl]-2-(4-methyl-2-pyridyl)pyridin-1-ium-1-yl]ethylamine Formula: C23H22N3S+ MolecularWeight: 372.50588

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC=C1)C2=[N+](C=CC(=C2)C=CC3=CSC4=CC=CC=C43)CCN

Isomeric SMILES

CC1=CC(=NC=C1)C2=[N+](C=CC(=C2)/C=C/C3=CSC4=CC=CC=C43)CCN

InChI

InChI=1S/C23H22N3S/c1-17-8-11-25-21(14-17)22-15-18(9-12-26(22)13-10-24)6-7-19-16-27-23-5-3-2-4-20(19)23/h2-9,11-12,14-16H,10,13,24H2,1H3/q+1/b7-6+