1-[2-(2-ethoxyphenyl)-2-oxidanylidene-ethyl]sulfanyl-3-methyl-pyrido[1,2-a]benzimidazole-4-carbonitrile

Systemtic Name: 1-[2-(2-ethoxyphenyl)-2-oxidanylidene-ethyl]sulfanyl-3-methyl-pyrido[1,2-a]benzimidazole-4-carbonitrile Openeye Name: 1-[2-(2-ethoxyphenyl)-2-oxo-ethyl]sulfanyl-3-methyl-pyrido[1,2-a]benzimidazole-4-carbonitrile CAS Name: 1-[[2-(2-ethoxyphenyl)-2-oxoethyl]thio]-3-methyl-4-pyrido[1,2-a]benzimidazolecarbonitrile IUPAC Name: 1-[2-(2-ethoxyphenyl)-2-oxoethyl]sulfanyl-3-methylpyrido[1,2-a]benzimidazole-4-carbonitrile Traditional Name: 1-[(2-keto-2-o-phenetyl-ethyl)thio]-3-methyl-pyrido[1,2-a]benzimidazole-4-carbonitrile Formula: C23H19N3O2S MolecularWeight: 401.48086

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1C(=O)CSC2=CC(=C(C3=NC4=CC=CC=C4N23)C#N)C

Isomeric SMILES

CCOC1=CC=CC=C1C(=O)CSC2=CC(=C(C3=NC4=CC=CC=C4N23)C#N)C

InChI

InChI=1S/C23H19N3O2S/c1-3-28-21-11-7-4-8-16(21)20(27)14-29-22-12-15(2)17(13-24)23-25-18-9-5-6-10-19(18)26(22)23/h4-12H,3,14H2,1-2H3