4-[4-[3-[2,4-bis(fluoranyl)phenyl]-3-oxidanyl-4-(1,2,4-triazol-1-yl)butan-2-yl]oxyphenyl]-N-[3-(trifluoromethyl)phenyl]piperazine-1-carboxamide

Systemtic Name: 4-[4-[3-[2,4-bis(fluoranyl)phenyl]-3-oxidanyl-4-(1,2,4-triazol-1-yl)butan-2-yl]oxyphenyl]-N-[3-(trifluoromethyl)phenyl]piperazine-1-carboxamide Openeye Name: 4-[4-[2-(2,4-difluorophenyl)-2-hydroxy-1-methyl-3-(1,2,4-triazol-1-yl)propoxy]phenyl]-N-[3-(trifluoromethyl)phenyl]piperazine-1-carboxamide CAS Name: 4-[4-[3-(2,4-difluorophenyl)-3-hydroxy-4-(1,2,4-triazol-1-yl)butan-2-yl]oxyphenyl]-N-[3-(trifluoromethyl)phenyl]-1-piperazinecarboxamide IUPAC Name: 4-[4-[3-(2,4-difluorophenyl)-3-hydroxy-4-(1,2,4-triazol-1-yl)butan-2-yl]oxyphenyl]-N-[3-(trifluoromethyl)phenyl]piperazine-1-carboxamide Traditional Name: 4-[4-[2-(2,4-difluorophenyl)-2-hydroxy-1-methyl-3-(1,2,4-triazol-1-yl)propoxy]phenyl]-N-[3-(trifluoromethyl)phenyl]piperazine-1-carboxamide Formula: C30H29F5N6O3 MolecularWeight: 616.581676

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(CN1C=NC=N1)(C2=C(C=C(C=C2)F)F)O)OC3=CC=C(C=C3)N4CCN(CC4)C(=O)NC5=CC=CC(=C5)C(F)(F)F

Isomeric SMILES

CC(C(CN1C=NC=N1)(C2=C(C=C(C=C2)F)F)O)OC3=CC=C(C=C3)N4CCN(CC4)C(=O)NC5=CC=CC(=C5)C(F)(F)F

InChI

InChI=1S/C30H29F5N6O3/c1-20(29(43,17-41-19-36-18-37-41)26-10-5-22(31)16-27(26)32)44-25-8-6-24(7-9-25)39-11-13-40(14-12-39)28(42)38-23-4-2-3-21(15-23)30(33,34)35/h2-10,15-16,18-20,43H,11-14,17H2,1H3,(H,38,42)