3-[3-[2,4-bis(fluoranyl)phenyl]-3-oxidanyl-4-(1,2,4-triazol-1-yl)butan-2-yl]-7-[2,2,3,3-tetrakis(fluoranyl)propoxy]quinazolin-4-one

Systemtic Name: 3-[3-[2,4-bis(fluoranyl)phenyl]-3-oxidanyl-4-(1,2,4-triazol-1-yl)butan-2-yl]-7-[2,2,3,3-tetrakis(fluoranyl)propoxy]quinazolin-4-one Openeye Name: 3-[2-(2,4-difluorophenyl)-2-hydroxy-1-methyl-3-(1,2,4-triazol-1-yl)propyl]-7-(2,2,3,3-tetrafluoropropoxy)quinazolin-4-one CAS Name: 3-[3-(2,4-difluorophenyl)-3-hydroxy-4-(1,2,4-triazol-1-yl)butan-2-yl]-7-(2,2,3,3-tetrafluoropropoxy)-4-quinazolinone IUPAC Name: 3-[3-(2,4-difluorophenyl)-3-hydroxy-4-(1,2,4-triazol-1-yl)butan-2-yl]-7-(2,2,3,3-tetrafluoropropoxy)quinazolin-4-one Traditional Name: 3-[2-(2,4-difluorophenyl)-2-hydroxy-1-methyl-3-(1,2,4-triazol-1-yl)propyl]-7-(2,2,3,3-tetrafluoropropoxy)quinazolin-4-one Formula: C23H19F6N5O3 MolecularWeight: 527.419079

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(CN1C=NC=N1)(C2=C(C=C(C=C2)F)F)O)N3C=NC4=C(C3=O)C=CC(=C4)OCC(C(F)F)(F)F

Isomeric SMILES

CC(C(CN1C=NC=N1)(C2=C(C=C(C=C2)F)F)O)N3C=NC4=C(C3=O)C=CC(=C4)OCC(C(F)F)(F)F

InChI

InChI=1S/C23H19F6N5O3/c1-13(22(36,8-33-11-30-10-32-33)17-5-2-14(24)6-18(17)25)34-12-31-19-7-15(3-4-16(19)20(34)35)37-9-23(28,29)21(26)27/h2-7,10-13,21,36H,8-9H2,1H3