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

Systemtic Name: 2-ethyl-1-[4-(4-fluorophenyl)sulfonylpiperazin-1-yl]-3-methyl-pyrido[1,2-a]benzimidazole-4-carbonitrile Openeye Name: 2-ethyl-1-[4-(4-fluorophenyl)sulfonylpiperazin-1-yl]-3-methyl-pyrido[1,2-a]benzimidazole-4-carbonitrile CAS Name: 2-ethyl-1-[4-(4-fluorophenyl)sulfonyl-1-piperazinyl]-3-methyl-4-pyrido[1,2-a]benzimidazolecarbonitrile IUPAC Name: 2-ethyl-1-[4-(4-fluorophenyl)sulfonylpiperazin-1-yl]-3-methylpyrido[1,2-a]benzimidazole-4-carbonitrile Traditional Name: 2-ethyl-1-[4-(4-fluorophenyl)sulfonylpiperazino]-3-methyl-pyrido[1,2-a]benzimidazole-4-carbonitrile Formula: C25H24FN5O2S MolecularWeight: 477.553763

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(N2C3=CC=CC=C3N=C2C(=C1C)C#N)N4CCN(CC4)S(=O)(=O)C5=CC=C(C=C5)F

Isomeric SMILES

CCC1=C(N2C3=CC=CC=C3N=C2C(=C1C)C#N)N4CCN(CC4)S(=O)(=O)C5=CC=C(C=C5)F

InChI

InChI=1S/C25H24FN5O2S/c1-3-20-17(2)21(16-27)24-28-22-6-4-5-7-23(22)31(24)25(20)29-12-14-30(15-13-29)34(32,33)19-10-8-18(26)9-11-19/h4-11H,3,12-15H2,1-2H3