1-[(3,4-dichlorophenyl)methylsulfanyl]-3-methyl-pyrido[1,2-a]benzimidazole-4-carbonitrile

Systemtic Name: 1-[(3,4-dichlorophenyl)methylsulfanyl]-3-methyl-pyrido[1,2-a]benzimidazole-4-carbonitrile Openeye Name: 1-[(3,4-dichlorophenyl)methylsulfanyl]-3-methyl-pyrido[1,2-a]benzimidazole-4-carbonitrile CAS Name: 1-[(3,4-dichlorophenyl)methylthio]-3-methyl-4-pyrido[1,2-a]benzimidazolecarbonitrile IUPAC Name: 1-[(3,4-dichlorophenyl)methylsulfanyl]-3-methylpyrido[1,2-a]benzimidazole-4-carbonitrile Traditional Name: 1-[(3,4-dichlorobenzyl)thio]-3-methyl-pyrido[1,2-a]benzimidazole-4-carbonitrile Formula: C20H13Cl2N3S MolecularWeight: 398.30832

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=NC3=CC=CC=C3N2C(=C1)SCC4=CC(=C(C=C4)Cl)Cl)C#N

Isomeric SMILES

CC1=C(C2=NC3=CC=CC=C3N2C(=C1)SCC4=CC(=C(C=C4)Cl)Cl)C#N

InChI

InChI=1S/C20H13Cl2N3S/c1-12-8-19(26-11-13-6-7-15(21)16(22)9-13)25-18-5-3-2-4-17(18)24-20(25)14(12)10-23/h2-9H,11H2,1H3