1-[(2-chloranyl-6-fluoranyl-phenyl)methylsulfanyl]-3-methyl-pyrido[1,2-a]benzimidazole-4-carbonitrile

Systemtic Name: 1-[(2-chloranyl-6-fluoranyl-phenyl)methylsulfanyl]-3-methyl-pyrido[1,2-a]benzimidazole-4-carbonitrile Openeye Name: 1-[(2-chloro-6-fluoro-phenyl)methylsulfanyl]-3-methyl-pyrido[1,2-a]benzimidazole-4-carbonitrile CAS Name: 1-[(2-chloro-6-fluorophenyl)methylthio]-3-methyl-4-pyrido[1,2-a]benzimidazolecarbonitrile IUPAC Name: 1-[(2-chloro-6-fluorophenyl)methylsulfanyl]-3-methylpyrido[1,2-a]benzimidazole-4-carbonitrile Traditional Name: 1-[(2-chloro-6-fluoro-benzyl)thio]-3-methyl-pyrido[1,2-a]benzimidazole-4-carbonitrile Formula: C20H13ClFN3S MolecularWeight: 381.853723

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=NC3=CC=CC=C3N2C(=C1)SCC4=C(C=CC=C4Cl)F)C#N

Isomeric SMILES

CC1=C(C2=NC3=CC=CC=C3N2C(=C1)SCC4=C(C=CC=C4Cl)F)C#N

InChI

InChI=1S/C20H13ClFN3S/c1-12-9-19(26-11-14-15(21)5-4-6-16(14)22)25-18-8-3-2-7-17(18)24-20(25)13(12)10-23/h2-9H,11H2,1H3