methyl 2-[[4-(2-cyanophenyl)sulfonylpiperazin-1-yl]methyl]imidazo[1,2-a]pyridine-8-carboxylate

Systemtic Name: methyl 2-[[4-(2-cyanophenyl)sulfonylpiperazin-1-yl]methyl]imidazo[1,2-a]pyridine-8-carboxylate Openeye Name: methyl 2-[[4-(2-cyanophenyl)sulfonylpiperazin-1-yl]methyl]imidazo[1,2-a]pyridine-8-carboxylate CAS Name: 2-[[4-(2-cyanophenyl)sulfonyl-1-piperazinyl]methyl]-8-imidazo[1,2-a]pyridinecarboxylic acid methyl ester IUPAC Name: methyl 2-[[4-(2-cyanophenyl)sulfonylpiperazin-1-yl]methyl]imidazo[1,2-a]pyridine-8-carboxylate Traditional Name: 2-[[4-(2-cyanophenyl)sulfonylpiperazino]methyl]imidazo[1,2-a]pyridine-8-carboxylic acid methyl ester Formula: C21H21N5O4S MolecularWeight: 439.48754

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CN2C1=NC(=C2)CN3CCN(CC3)S(=O)(=O)C4=CC=CC=C4C#N

Isomeric SMILES

COC(=O)C1=CC=CN2C1=NC(=C2)CN3CCN(CC3)S(=O)(=O)C4=CC=CC=C4C#N

InChI

InChI=1S/C21H21N5O4S/c1-30-21(27)18-6-4-8-25-15-17(23-20(18)25)14-24-9-11-26(12-10-24)31(28,29)19-7-3-2-5-16(19)13-22/h2-8,15H,9-12,14H2,1H3