N-[[3-fluoranyl-4-(4-oxidanylpiperidin-1-yl)phenyl]methyl]-1-methyl-4-piperidin-1-ylsulfonyl-pyrrole-2-carboxamide

Systemtic Name: N-[[3-fluoranyl-4-(4-oxidanylpiperidin-1-yl)phenyl]methyl]-1-methyl-4-piperidin-1-ylsulfonyl-pyrrole-2-carboxamide Openeye Name: N-[[3-fluoro-4-(4-hydroxy-1-piperidyl)phenyl]methyl]-1-methyl-4-(1-piperidylsulfonyl)pyrrole-2-carboxamide CAS Name: N-[[3-fluoro-4-(4-hydroxy-1-piperidinyl)phenyl]methyl]-1-methyl-4-(1-piperidinylsulfonyl)-2-pyrrolecarboxamide IUPAC Name: N-[[3-fluoro-4-(4-hydroxypiperidin-1-yl)phenyl]methyl]-1-methyl-4-piperidin-1-ylsulfonylpyrrole-2-carboxamide Traditional Name: N-[3-fluoro-4-(4-hydroxypiperidino)benzyl]-1-methyl-4-piperidinosulfonyl-pyrrole-2-carboxamide Formula: C23H31FN4O4S MolecularWeight: 478.580043

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=C1C(=O)NCC2=CC(=C(C=C2)N3CCC(CC3)O)F)S(=O)(=O)N4CCCCC4

Isomeric SMILES

CN1C=C(C=C1C(=O)NCC2=CC(=C(C=C2)N3CCC(CC3)O)F)S(=O)(=O)N4CCCCC4

InChI

InChI=1S/C23H31FN4O4S/c1-26-16-19(33(31,32)28-9-3-2-4-10-28)14-22(26)23(30)25-15-17-5-6-21(20(24)13-17)27-11-7-18(29)8-12-27/h5-6,13-14,16,18,29H,2-4,7-12,15H2,1H3,(H,25,30)