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

Systemtic Name: 4-[4-[3-[bis(fluoranyl)methoxy]phenyl]carbonylpiperazin-1-yl]sulfonyl-1-methyl-pyrrole-2-carboxamide Openeye Name: 4-[4-[3-(difluoromethoxy)benzoyl]piperazin-1-yl]sulfonyl-1-methyl-pyrrole-2-carboxamide CAS Name: 4-[[4-[[3-(difluoromethoxy)phenyl]-oxomethyl]-1-piperazinyl]sulfonyl]-1-methyl-2-pyrrolecarboxamide IUPAC Name: 4-[4-[3-(difluoromethoxy)benzoyl]piperazin-1-yl]sulfonyl-1-methylpyrrole-2-carboxamide Traditional Name: 4-[4-[3-(difluoromethoxy)benzoyl]piperazino]sulfonyl-1-methyl-pyrrole-2-carboxamide Formula: C18H20F2N4O5S MolecularWeight: 442.437006

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H20F2N4O5S/c1-22-11-14(10-15(22)16(21)25)30(27,28)24-7-5-23(6-8-24)17(26)12-3-2-4-13(9-12)29-18(19)20/h2-4,9-11,18H,5-8H2,1H3,(H2,21,25)