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

Systemtic Name: 1-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-3-propyl-pyrido[1,2-a]benzimidazole-4-carbonitrile Openeye Name: 3-propyl-1-[4-(p-tolylsulfonyl)piperazin-1-yl]pyrido[1,2-a]benzimidazole-4-carbonitrile CAS Name: 1-[4-(4-methylphenyl)sulfonyl-1-piperazinyl]-3-propyl-4-pyrido[1,2-a]benzimidazolecarbonitrile IUPAC Name: 1-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-3-propylpyrido[1,2-a]benzimidazole-4-carbonitrile Traditional Name: 3-propyl-1-(4-tosylpiperazino)pyrido[1,2-a]benzimidazole-4-carbonitrile Formula: C26H27N5O2S MolecularWeight: 473.58988

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C2=NC3=CC=CC=C3N2C(=C1)N4CCN(CC4)S(=O)(=O)C5=CC=C(C=C5)C)C#N

Isomeric SMILES

CCCC1=C(C2=NC3=CC=CC=C3N2C(=C1)N4CCN(CC4)S(=O)(=O)C5=CC=C(C=C5)C)C#N

InChI

InChI=1S/C26H27N5O2S/c1-3-6-20-17-25(31-24-8-5-4-7-23(24)28-26(31)22(20)18-27)29-13-15-30(16-14-29)34(32,33)21-11-9-19(2)10-12-21/h4-5,7-12,17H,3,6,13-16H2,1-2H3