3-methyl-1-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]pyrido[1,2-a]benzimidazole-4-carbonitrile

Systemtic Name: 3-methyl-1-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]pyrido[1,2-a]benzimidazole-4-carbonitrile Openeye Name: 3-methyl-1-[4-(p-tolylsulfonyl)piperazin-1-yl]pyrido[1,2-a]benzimidazole-4-carbonitrile CAS Name: 3-methyl-1-[4-(4-methylphenyl)sulfonyl-1-piperazinyl]-4-pyrido[1,2-a]benzimidazolecarbonitrile IUPAC Name: 3-methyl-1-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]pyrido[1,2-a]benzimidazole-4-carbonitrile Traditional Name: 3-methyl-1-(4-tosylpiperazino)pyrido[1,2-a]benzimidazole-4-carbonitrile Formula: C24H23N5O2S MolecularWeight: 445.53672

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C3=CC(=C(C4=NC5=CC=CC=C5N34)C#N)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C3=CC(=C(C4=NC5=CC=CC=C5N34)C#N)C

InChI

InChI=1S/C24H23N5O2S/c1-17-7-9-19(10-8-17)32(30,31)28-13-11-27(12-14-28)23-15-18(2)20(16-25)24-26-21-5-3-4-6-22(21)29(23)24/h3-10,15H,11-14H2,1-2H3