1-(2-ethoxyphenyl)-N-(4-methylphenyl)-2-sulfanyl-imidazo[1,2-a]pyridin-4-ium-3-carboxamide

Systemtic Name: 1-(2-ethoxyphenyl)-N-(4-methylphenyl)-2-sulfanyl-imidazo[1,2-a]pyridin-4-ium-3-carboxamide Openeye Name: 1-(2-ethoxyphenyl)-N-(p-tolyl)-2-sulfanyl-imidazo[1,2-a]pyridin-4-ium-3-carboxamide CAS Name: 1-(2-ethoxyphenyl)-2-mercapto-N-(4-methylphenyl)-3-imidazo[1,2-a]pyridin-4-iumcarboxamide IUPAC Name: 1-(2-ethoxyphenyl)-N-(4-methylphenyl)-2-sulfanylimidazo[1,2-a]pyridin-4-ium-3-carboxamide Traditional Name: 2-mercapto-1-o-phenetyl-N-(p-tolyl)imidazo[1,2-a]pyridin-4-ium-3-carboxamide Formula: C23H22N3O2S+ MolecularWeight: 404.50468

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1N2C3=CC=CC=[N+]3C(=C2S)C(=O)NC4=CC=C(C=C4)C

Isomeric SMILES

CCOC1=CC=CC=C1N2C3=CC=CC=[N+]3C(=C2S)C(=O)NC4=CC=C(C=C4)C

InChI

InChI=1S/C23H21N3O2S/c1-3-28-19-9-5-4-8-18(19)26-20-10-6-7-15-25(20)21(23(26)29)22(27)24-17-13-11-16(2)12-14-17/h4-15H,3H2,1-2H3,(H-,24,27,29)/p+1