1-methyl-4-[4-[2-methyl-6-(trifluoromethyl)pyridin-3-yl]carbonylpiperazin-1-yl]sulfonyl-pyrrole-2-carboxamide

Systemtic Name: 1-methyl-4-[4-[2-methyl-6-(trifluoromethyl)pyridin-3-yl]carbonylpiperazin-1-yl]sulfonyl-pyrrole-2-carboxamide Openeye Name: 1-methyl-4-[4-[2-methyl-6-(trifluoromethyl)pyridine-3-carbonyl]piperazin-1-yl]sulfonyl-pyrrole-2-carboxamide CAS Name: 1-methyl-4-[[4-[[2-methyl-6-(trifluoromethyl)-3-pyridinyl]-oxomethyl]-1-piperazinyl]sulfonyl]-2-pyrrolecarboxamide IUPAC Name: 1-methyl-4-[4-[2-methyl-6-(trifluoromethyl)pyridine-3-carbonyl]piperazin-1-yl]sulfonylpyrrole-2-carboxamide Traditional Name: 1-methyl-4-[4-[2-methyl-6-(trifluoromethyl)nicotinoyl]piperazino]sulfonyl-pyrrole-2-carboxamide Formula: C18H20F3N5O4S MolecularWeight: 459.44271

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=N1)C(F)(F)F)C(=O)N2CCN(CC2)S(=O)(=O)C3=CN(C(=C3)C(=O)N)C

Isomeric SMILES

CC1=C(C=CC(=N1)C(F)(F)F)C(=O)N2CCN(CC2)S(=O)(=O)C3=CN(C(=C3)C(=O)N)C

InChI

InChI=1S/C18H20F3N5O4S/c1-11-13(3-4-15(23-11)18(19,20)21)17(28)25-5-7-26(8-6-25)31(29,30)12-9-14(16(22)27)24(2)10-12/h3-4,9-10H,5-8H2,1-2H3,(H2,22,27)