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

Systemtic Name: 1-[(2-bromophenyl)methylsulfanyl]-3-methyl-pyrido[1,2-a]benzimidazole-4-carbonitrile Openeye Name: 1-[(2-bromophenyl)methylsulfanyl]-3-methyl-pyrido[1,2-a]benzimidazole-4-carbonitrile CAS Name: 1-[(2-bromophenyl)methylthio]-3-methyl-4-pyrido[1,2-a]benzimidazolecarbonitrile IUPAC Name: 1-[(2-bromophenyl)methylsulfanyl]-3-methylpyrido[1,2-a]benzimidazole-4-carbonitrile Traditional Name: 1-[(2-bromobenzyl)thio]-3-methyl-pyrido[1,2-a]benzimidazole-4-carbonitrile Formula: C20H14BrN3S MolecularWeight: 408.31426

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=NC3=CC=CC=C3N2C(=C1)SCC4=CC=CC=C4Br)C#N

Isomeric SMILES

CC1=C(C2=NC3=CC=CC=C3N2C(=C1)SCC4=CC=CC=C4Br)C#N

InChI

InChI=1S/C20H14BrN3S/c1-13-10-19(25-12-14-6-2-3-7-16(14)21)24-18-9-5-4-8-17(18)23-20(24)15(13)11-22/h2-10H,12H2,1H3