2-ethyl-3-methyl-1-pentylsulfanyl-pyrido[1,2-a]benzimidazole-4-carbonitrile

Systemtic Name: 2-ethyl-3-methyl-1-pentylsulfanyl-pyrido[1,2-a]benzimidazole-4-carbonitrile Openeye Name: 2-ethyl-3-methyl-1-pentylsulfanyl-pyrido[1,2-a]benzimidazole-4-carbonitrile CAS Name: 2-ethyl-3-methyl-1-(pentylthio)-4-pyrido[1,2-a]benzimidazolecarbonitrile IUPAC Name: 2-ethyl-3-methyl-1-pentylsulfanylpyrido[1,2-a]benzimidazole-4-carbonitrile Traditional Name: 1-(amylthio)-2-ethyl-3-methyl-pyrido[1,2-a]benzimidazole-4-carbonitrile Formula: C20H23N3S MolecularWeight: 337.48172

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCSC1=C(C(=C(C2=NC3=CC=CC=C3N12)C#N)C)CC

Isomeric SMILES

CCCCCSC1=C(C(=C(C2=NC3=CC=CC=C3N12)C#N)C)CC

InChI

InChI=1S/C20H23N3S/c1-4-6-9-12-24-20-15(5-2)14(3)16(13-21)19-22-17-10-7-8-11-18(17)23(19)20/h7-8,10-11H,4-6,9,12H2,1-3H3