1-methyl-4-[4-[3-(trifluoromethyl)phenyl]carbonylpiperazin-1-yl]sulfonyl-pyrrole-2-carboxamide

Systemtic Name: 1-methyl-4-[4-[3-(trifluoromethyl)phenyl]carbonylpiperazin-1-yl]sulfonyl-pyrrole-2-carboxamide Openeye Name: 1-methyl-4-[4-[3-(trifluoromethyl)benzoyl]piperazin-1-yl]sulfonyl-pyrrole-2-carboxamide CAS Name: 1-methyl-4-[[4-[oxo-[3-(trifluoromethyl)phenyl]methyl]-1-piperazinyl]sulfonyl]-2-pyrrolecarboxamide IUPAC Name: 1-methyl-4-[4-[3-(trifluoromethyl)benzoyl]piperazin-1-yl]sulfonylpyrrole-2-carboxamide Traditional Name: 1-methyl-4-[4-[3-(trifluoromethyl)benzoyl]piperazino]sulfonyl-pyrrole-2-carboxamide Formula: C18H19F3N4O4S MolecularWeight: 444.42807

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=C1C(=O)N)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC(=CC=C3)C(F)(F)F

Isomeric SMILES

CN1C=C(C=C1C(=O)N)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC(=CC=C3)C(F)(F)F

InChI

InChI=1S/C18H19F3N4O4S/c1-23-11-14(10-15(23)16(22)26)30(28,29)25-7-5-24(6-8-25)17(27)12-3-2-4-13(9-12)18(19,20)21/h2-4,9-11H,5-8H2,1H3,(H2,22,26)