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

Systemtic Name: 3-methyl-1-[(4-oxidanylidene-1H-quinazolin-2-yl)methylsulfanyl]pyrido[1,2-a]benzimidazole-4-carbonitrile Openeye Name: 3-methyl-1-[(4-oxo-1H-quinazolin-2-yl)methylsulfanyl]pyrido[1,2-a]benzimidazole-4-carbonitrile CAS Name: 3-methyl-1-[(4-oxo-1H-quinazolin-2-yl)methylthio]-4-pyrido[1,2-a]benzimidazolecarbonitrile IUPAC Name: 3-methyl-1-[(4-oxo-1H-quinazolin-2-yl)methylsulfanyl]pyrido[1,2-a]benzimidazole-4-carbonitrile Traditional Name: 1-[(4-keto-1H-quinazolin-2-yl)methylthio]-3-methyl-pyrido[1,2-a]benzimidazole-4-carbonitrile Formula: C22H15N5OS MolecularWeight: 397.4524

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=NC3=CC=CC=C3N2C(=C1)SCC4=NC(=O)C5=CC=CC=C5N4)C#N

Isomeric SMILES

CC1=C(C2=NC3=CC=CC=C3N2C(=C1)SCC4=NC(=O)C5=CC=CC=C5N4)C#N

InChI

InChI=1S/C22H15N5OS/c1-13-10-20(27-18-9-5-4-8-17(18)25-21(27)15(13)11-23)29-12-19-24-16-7-3-2-6-14(16)22(28)26-19/h2-10H,12H2,1H3,(H,24,26,28)