1-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]-3-methyl-pyrido[1,2-a]benzimidazole-4-carbonitrile

Systemtic Name: 1-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]-3-methyl-pyrido[1,2-a]benzimidazole-4-carbonitrile Openeye Name: 1-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]-3-methyl-pyrido[1,2-a]benzimidazole-4-carbonitrile CAS Name: 1-[4-(2,5-dimethylphenyl)sulfonyl-1-piperazinyl]-3-methyl-4-pyrido[1,2-a]benzimidazolecarbonitrile IUPAC Name: 1-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]-3-methylpyrido[1,2-a]benzimidazole-4-carbonitrile Traditional Name: 1-[4-(2,5-dimethylphenyl)sulfonylpiperazino]-3-methyl-pyrido[1,2-a]benzimidazole-4-carbonitrile Formula: C25H25N5O2S MolecularWeight: 459.5633

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H25N5O2S/c1-17-8-9-18(2)23(14-17)33(31,32)29-12-10-28(11-13-29)24-15-19(3)20(16-26)25-27-21-6-4-5-7-22(21)30(24)25/h4-9,14-15H,10-13H2,1-3H3