1-[(4,5-diphenyl-1,2,4-triazol-3-yl)sulfanyl]-3-methyl-pyrido[1,2-a]benzimidazole-4-carbonitrile

Systemtic Name: 1-[(4,5-diphenyl-1,2,4-triazol-3-yl)sulfanyl]-3-methyl-pyrido[1,2-a]benzimidazole-4-carbonitrile Openeye Name: 1-[(4,5-diphenyl-1,2,4-triazol-3-yl)sulfanyl]-3-methyl-pyrido[1,2-a]benzimidazole-4-carbonitrile CAS Name: 1-[(4,5-diphenyl-1,2,4-triazol-3-yl)thio]-3-methyl-4-pyrido[1,2-a]benzimidazolecarbonitrile IUPAC Name: 1-[(4,5-diphenyl-1,2,4-triazol-3-yl)sulfanyl]-3-methylpyrido[1,2-a]benzimidazole-4-carbonitrile Traditional Name: 1-[(4,5-diphenyl-1,2,4-triazol-3-yl)thio]-3-methyl-pyrido[1,2-a]benzimidazole-4-carbonitrile Formula: C27H18N6S MolecularWeight: 458.53702

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=NC3=CC=CC=C3N2C(=C1)SC4=NN=C(N4C5=CC=CC=C5)C6=CC=CC=C6)C#N

Isomeric SMILES

CC1=C(C2=NC3=CC=CC=C3N2C(=C1)SC4=NN=C(N4C5=CC=CC=C5)C6=CC=CC=C6)C#N

InChI

InChI=1S/C27H18N6S/c1-18-16-24(33-23-15-9-8-14-22(23)29-26(33)21(18)17-28)34-27-31-30-25(19-10-4-2-5-11-19)32(27)20-12-6-3-7-13-20/h2-16H,1H3