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

Systemtic Name: 3-methyl-1-[(4-oxidanylidene-1,2,3-benzotriazin-3-yl)methylsulfanyl]pyrido[1,2-a]benzimidazole-4-carbonitrile Openeye Name: 3-methyl-1-[(4-oxo-1,2,3-benzotriazin-3-yl)methylsulfanyl]pyrido[1,2-a]benzimidazole-4-carbonitrile CAS Name: 3-methyl-1-[(4-oxo-1,2,3-benzotriazin-3-yl)methylthio]-4-pyrido[1,2-a]benzimidazolecarbonitrile IUPAC Name: 3-methyl-1-[(4-oxo-1,2,3-benzotriazin-3-yl)methylsulfanyl]pyrido[1,2-a]benzimidazole-4-carbonitrile Traditional Name: 1-[(4-keto-1,2,3-benzotriazin-3-yl)methylthio]-3-methyl-pyrido[1,2-a]benzimidazole-4-carbonitrile Formula: C21H14N6OS MolecularWeight: 398.44046

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=NC3=CC=CC=C3N2C(=C1)SCN4C(=O)C5=CC=CC=C5N=N4)C#N

Isomeric SMILES

CC1=C(C2=NC3=CC=CC=C3N2C(=C1)SCN4C(=O)C5=CC=CC=C5N=N4)C#N

InChI

InChI=1S/C21H14N6OS/c1-13-10-19(27-18-9-5-4-8-17(18)23-20(27)15(13)11-22)29-12-26-21(28)14-6-2-3-7-16(14)24-25-26/h2-10H,12H2,1H3