N,N-diethyl-1-methyl-5-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]carbonyl-pyrrole-3-sulfonamide

Systemtic Name: N,N-diethyl-1-methyl-5-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]carbonyl-pyrrole-3-sulfonamide Openeye Name: N,N-diethyl-1-methyl-5-[4-[3-(trifluoromethyl)phenyl]piperazine-1-carbonyl]pyrrole-3-sulfonamide CAS Name: N,N-diethyl-1-methyl-5-[oxo-[4-[3-(trifluoromethyl)phenyl]-1-piperazinyl]methyl]-3-pyrrolesulfonamide IUPAC Name: N,N-diethyl-1-methyl-5-[4-[3-(trifluoromethyl)phenyl]piperazine-1-carbonyl]pyrrole-3-sulfonamide Traditional Name: N,N-diethyl-1-methyl-5-[4-[3-(trifluoromethyl)phenyl]piperazine-1-carbonyl]pyrrole-3-sulfonamide Formula: C21H27F3N4O3S MolecularWeight: 472.52429

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CN(C(=C1)C(=O)N2CCN(CC2)C3=CC=CC(=C3)C(F)(F)F)C

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CN(C(=C1)C(=O)N2CCN(CC2)C3=CC=CC(=C3)C(F)(F)F)C

InChI

InChI=1S/C21H27F3N4O3S/c1-4-28(5-2)32(30,31)18-14-19(25(3)15-18)20(29)27-11-9-26(10-12-27)17-8-6-7-16(13-17)21(22,23)24/h6-8,13-15H,4-5,9-12H2,1-3H3