1-[(3-cyanophenyl)methylsulfanyl]-3-ethyl-pyrido[1,2-a]benzimidazole-4-carbonitrile

Systemtic Name: 1-[(3-cyanophenyl)methylsulfanyl]-3-ethyl-pyrido[1,2-a]benzimidazole-4-carbonitrile Openeye Name: 1-[(3-cyanophenyl)methylsulfanyl]-3-ethyl-pyrido[1,2-a]benzimidazole-4-carbonitrile CAS Name: 1-[(3-cyanophenyl)methylthio]-3-ethyl-4-pyrido[1,2-a]benzimidazolecarbonitrile IUPAC Name: 1-[(3-cyanophenyl)methylsulfanyl]-3-ethylpyrido[1,2-a]benzimidazole-4-carbonitrile Traditional Name: 1-[(3-cyanobenzyl)thio]-3-ethyl-pyrido[1,2-a]benzimidazole-4-carbonitrile Formula: C22H16N4S MolecularWeight: 368.45424

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C2=NC3=CC=CC=C3N2C(=C1)SCC4=CC=CC(=C4)C#N)C#N

Isomeric SMILES

CCC1=C(C2=NC3=CC=CC=C3N2C(=C1)SCC4=CC=CC(=C4)C#N)C#N

InChI

InChI=1S/C22H16N4S/c1-2-17-11-21(27-14-16-7-5-6-15(10-16)12-23)26-20-9-4-3-8-19(20)25-22(26)18(17)13-24/h3-11H,2,14H2,1H3