3-ethyl-1-(1H-1,2,4-triazol-5-ylsulfanyl)pyrido[1,2-a]benzimidazole-4-carbonitrile

Systemtic Name: 3-ethyl-1-(1H-1,2,4-triazol-5-ylsulfanyl)pyrido[1,2-a]benzimidazole-4-carbonitrile Openeye Name: 3-ethyl-1-(1H-1,2,4-triazol-5-ylsulfanyl)pyrido[1,2-a]benzimidazole-4-carbonitrile CAS Name: 3-ethyl-1-(1H-1,2,4-triazol-5-ylthio)-4-pyrido[1,2-a]benzimidazolecarbonitrile IUPAC Name: 3-ethyl-1-(1H-1,2,4-triazol-5-ylsulfanyl)pyrido[1,2-a]benzimidazole-4-carbonitrile Traditional Name: 3-ethyl-1-(1H-1,2,4-triazol-5-ylthio)pyrido[1,2-a]benzimidazole-4-carbonitrile Formula: C16H12N6S MolecularWeight: 320.37168

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C2=NC3=CC=CC=C3N2C(=C1)SC4=NC=NN4)C#N

Isomeric SMILES

CCC1=C(C2=NC3=CC=CC=C3N2C(=C1)SC4=NC=NN4)C#N

InChI

InChI=1S/C16H12N6S/c1-2-10-7-14(23-16-18-9-19-21-16)22-13-6-4-3-5-12(13)20-15(22)11(10)8-17/h3-7,9H,2H2,1H3,(H,18,19,21)