1-[2-(4-methoxyphenoxy)ethylsulfanyl]-3-methyl-pyrido[1,2-a]benzimidazole-4-carbonitrile

Systemtic Name: 1-[2-(4-methoxyphenoxy)ethylsulfanyl]-3-methyl-pyrido[1,2-a]benzimidazole-4-carbonitrile Openeye Name: 1-[2-(4-methoxyphenoxy)ethylsulfanyl]-3-methyl-pyrido[1,2-a]benzimidazole-4-carbonitrile CAS Name: 1-[2-(4-methoxyphenoxy)ethylthio]-3-methyl-4-pyrido[1,2-a]benzimidazolecarbonitrile IUPAC Name: 1-[2-(4-methoxyphenoxy)ethylsulfanyl]-3-methylpyrido[1,2-a]benzimidazole-4-carbonitrile Traditional Name: 1-[2-(4-methoxyphenoxy)ethylthio]-3-methyl-pyrido[1,2-a]benzimidazole-4-carbonitrile Formula: C22H19N3O2S MolecularWeight: 389.47016

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=NC3=CC=CC=C3N2C(=C1)SCCOC4=CC=C(C=C4)OC)C#N

Isomeric SMILES

CC1=C(C2=NC3=CC=CC=C3N2C(=C1)SCCOC4=CC=C(C=C4)OC)C#N

InChI

InChI=1S/C22H19N3O2S/c1-15-13-21(28-12-11-27-17-9-7-16(26-2)8-10-17)25-20-6-4-3-5-19(20)24-22(25)18(15)14-23/h3-10,13H,11-12H2,1-2H3