methyl 2,4-dimethyl-5-[4-[4-(trifluoromethyloxy)phenyl]sulfonylpiperazin-1-yl]carbonyl-1H-pyrrole-3-carboxylate

Systemtic Name: methyl 2,4-dimethyl-5-[4-[4-(trifluoromethyloxy)phenyl]sulfonylpiperazin-1-yl]carbonyl-1H-pyrrole-3-carboxylate Openeye Name: methyl 2,4-dimethyl-5-[4-[4-(trifluoromethoxy)phenyl]sulfonylpiperazine-1-carbonyl]-1H-pyrrole-3-carboxylate CAS Name: 2,4-dimethyl-5-[oxo-[4-[4-(trifluoromethoxy)phenyl]sulfonyl-1-piperazinyl]methyl]-1H-pyrrole-3-carboxylic acid methyl ester IUPAC Name: methyl 2,4-dimethyl-5-[4-[4-(trifluoromethoxy)phenyl]sulfonylpiperazine-1-carbonyl]-1H-pyrrole-3-carboxylate Traditional Name: 2,4-dimethyl-5-[4-[4-(trifluoromethoxy)phenyl]sulfonylpiperazine-1-carbonyl]-1H-pyrrole-3-carboxylic acid methyl ester Formula: C20H22F3N3O6S MolecularWeight: 489.46539

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1C(=O)OC)C)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)OC(F)(F)F

Isomeric SMILES

CC1=C(NC(=C1C(=O)OC)C)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)OC(F)(F)F

InChI

InChI=1S/C20H22F3N3O6S/c1-12-16(19(28)31-3)13(2)24-17(12)18(27)25-8-10-26(11-9-25)33(29,30)15-6-4-14(5-7-15)32-20(21,22)23/h4-7,24H,8-11H2,1-3H3