methyl 6-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]carbonylpyridine-2-carboxylate

Systemtic Name: methyl 6-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]carbonylpyridine-2-carboxylate Openeye Name: methyl 6-[4-(2,5-dimethylphenyl)sulfonylpiperazine-1-carbonyl]pyridine-2-carboxylate CAS Name: 6-[[4-(2,5-dimethylphenyl)sulfonyl-1-piperazinyl]-oxomethyl]-2-pyridinecarboxylic acid methyl ester IUPAC Name: methyl 6-[4-(2,5-dimethylphenyl)sulfonylpiperazine-1-carbonyl]pyridine-2-carboxylate Traditional Name: 6-[4-(2,5-dimethylphenyl)sulfonylpiperazine-1-carbonyl]picolinic acid methyl ester Formula: C20H23N3O5S MolecularWeight: 417.47872

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)S(=O)(=O)N2CCN(CC2)C(=O)C3=NC(=CC=C3)C(=O)OC

Isomeric SMILES

CC1=CC(=C(C=C1)C)S(=O)(=O)N2CCN(CC2)C(=O)C3=NC(=CC=C3)C(=O)OC

InChI

InChI=1S/C20H23N3O5S/c1-14-7-8-15(2)18(13-14)29(26,27)23-11-9-22(10-12-23)19(24)16-5-4-6-17(21-16)20(25)28-3/h4-8,13H,9-12H2,1-3H3