methyl 4-[[1-[(2,5-dimethylphenyl)methyl]piperidin-4-yl]methylsulfamoyl]-1H-pyrrole-2-carboxylate

Systemtic Name: methyl 4-[[1-[(2,5-dimethylphenyl)methyl]piperidin-4-yl]methylsulfamoyl]-1H-pyrrole-2-carboxylate Openeye Name: methyl 4-[[1-[(2,5-dimethylphenyl)methyl]-4-piperidyl]methylsulfamoyl]-1H-pyrrole-2-carboxylate CAS Name: 4-[[1-[(2,5-dimethylphenyl)methyl]-4-piperidinyl]methylsulfamoyl]-1H-pyrrole-2-carboxylic acid methyl ester IUPAC Name: methyl 4-[[1-[(2,5-dimethylphenyl)methyl]piperidin-4-yl]methylsulfamoyl]-1H-pyrrole-2-carboxylate Traditional Name: 4-[[1-(2,5-dimethylbenzyl)-4-piperidyl]methylsulfamoyl]-1H-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)C)CN2CCC(CC2)CNS(=O)(=O)C3=CNC(=C3)C(=O)OC

Isomeric SMILES

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

InChI

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