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

Systemtic Name: 3-ethyl-1-[(4-fluorophenyl)methylsulfanyl]pyrido[1,2-a]benzimidazole-4-carbonitrile Openeye Name: 3-ethyl-1-[(4-fluorophenyl)methylsulfanyl]pyrido[1,2-a]benzimidazole-4-carbonitrile CAS Name: 3-ethyl-1-[(4-fluorophenyl)methylthio]-4-pyrido[1,2-a]benzimidazolecarbonitrile IUPAC Name: 3-ethyl-1-[(4-fluorophenyl)methylsulfanyl]pyrido[1,2-a]benzimidazole-4-carbonitrile Traditional Name: 3-ethyl-1-[(4-fluorobenzyl)thio]pyrido[1,2-a]benzimidazole-4-carbonitrile Formula: C21H16FN3S MolecularWeight: 361.435243

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H16FN3S/c1-2-15-11-20(26-13-14-7-9-16(22)10-8-14)25-19-6-4-3-5-18(19)24-21(25)17(15)12-23/h3-11H,2,13H2,1H3