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

Systemtic Name: 3-ethyl-1-[2-(4-methylpiperidin-1-yl)-2-oxidanylidene-ethyl]sulfanyl-pyrido[1,2-a]benzimidazole-4-carbonitrile Openeye Name: 3-ethyl-1-[2-(4-methyl-1-piperidyl)-2-oxo-ethyl]sulfanyl-pyrido[1,2-a]benzimidazole-4-carbonitrile CAS Name: 3-ethyl-1-[[2-(4-methyl-1-piperidinyl)-2-oxoethyl]thio]-4-pyrido[1,2-a]benzimidazolecarbonitrile IUPAC Name: 3-ethyl-1-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]sulfanylpyrido[1,2-a]benzimidazole-4-carbonitrile Traditional Name: 3-ethyl-1-[[2-keto-2-(4-methylpiperidino)ethyl]thio]pyrido[1,2-a]benzimidazole-4-carbonitrile Formula: C22H24N4OS MolecularWeight: 392.51716

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C2=NC3=CC=CC=C3N2C(=C1)SCC(=O)N4CCC(CC4)C)C#N

Isomeric SMILES

CCC1=C(C2=NC3=CC=CC=C3N2C(=C1)SCC(=O)N4CCC(CC4)C)C#N

InChI

InChI=1S/C22H24N4OS/c1-3-16-12-21(28-14-20(27)25-10-8-15(2)9-11-25)26-19-7-5-4-6-18(19)24-22(26)17(16)13-23/h4-7,12,15H,3,8-11,14H2,1-2H3