methyl 1-methyl-4-[[1-[(4-methylphenyl)methyl]piperidin-4-yl]methylsulfamoyl]pyrrole-2-carboxylate

Systemtic Name: methyl 1-methyl-4-[[1-[(4-methylphenyl)methyl]piperidin-4-yl]methylsulfamoyl]pyrrole-2-carboxylate Openeye Name: methyl 1-methyl-4-[[1-(p-tolylmethyl)-4-piperidyl]methylsulfamoyl]pyrrole-2-carboxylate CAS Name: 1-methyl-4-[[1-[(4-methylphenyl)methyl]-4-piperidinyl]methylsulfamoyl]-2-pyrrolecarboxylic acid methyl ester IUPAC Name: methyl 1-methyl-4-[[1-[(4-methylphenyl)methyl]piperidin-4-yl]methylsulfamoyl]pyrrole-2-carboxylate Traditional Name: 1-methyl-4-[[1-(4-methylbenzyl)-4-piperidyl]methylsulfamoyl]pyrrole-2-carboxylic acid methyl ester Formula: C21H29N3O4S MolecularWeight: 419.53766

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2CCC(CC2)CNS(=O)(=O)C3=CN(C(=C3)C(=O)OC)C

Isomeric SMILES

CC1=CC=C(C=C1)CN2CCC(CC2)CNS(=O)(=O)C3=CN(C(=C3)C(=O)OC)C

InChI

InChI=1S/C21H29N3O4S/c1-16-4-6-18(7-5-16)14-24-10-8-17(9-11-24)13-22-29(26,27)19-12-20(21(25)28-3)23(2)15-19/h4-7,12,15,17,22H,8-11,13-14H2,1-3H3