3-(3,5-dimethylphenyl)-2-[(4-thiophen-2-ylsulfonylpiperazin-1-yl)methyl]imidazo[4,5-b]pyridine

Systemtic Name: 3-(3,5-dimethylphenyl)-2-[(4-thiophen-2-ylsulfonylpiperazin-1-yl)methyl]imidazo[4,5-b]pyridine Openeye Name: 3-(3,5-dimethylphenyl)-2-[[4-(2-thienylsulfonyl)piperazin-1-yl]methyl]imidazo[4,5-b]pyridine CAS Name: 3-(3,5-dimethylphenyl)-2-[(4-thiophen-2-ylsulfonyl-1-piperazinyl)methyl]imidazo[4,5-b]pyridine IUPAC Name: 3-(3,5-dimethylphenyl)-2-[(4-thiophen-2-ylsulfonylpiperazin-1-yl)methyl]imidazo[4,5-b]pyridine Traditional Name: 3-(3,5-dimethylphenyl)-2-[[4-(2-thienylsulfonyl)piperazino]methyl]imidazo[4,5-b]pyridine Formula: C23H25N5O2S2 MolecularWeight: 467.6069

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)N2C(=NC3=C2N=CC=C3)CN4CCN(CC4)S(=O)(=O)C5=CC=CS5)C

Isomeric SMILES

CC1=CC(=CC(=C1)N2C(=NC3=C2N=CC=C3)CN4CCN(CC4)S(=O)(=O)C5=CC=CS5)C

InChI

InChI=1S/C23H25N5O2S2/c1-17-13-18(2)15-19(14-17)28-21(25-20-5-3-7-24-23(20)28)16-26-8-10-27(11-9-26)32(29,30)22-6-4-12-31-22/h3-7,12-15H,8-11,16H2,1-2H3