7-azanyl-3-[3-[2,4-bis(fluoranyl)phenyl]-3-oxidanyl-4-(1,2,4-triazol-1-yl)butan-2-yl]-6-fluoranyl-quinazolin-4-one

Systemtic Name: 7-azanyl-3-[3-[2,4-bis(fluoranyl)phenyl]-3-oxidanyl-4-(1,2,4-triazol-1-yl)butan-2-yl]-6-fluoranyl-quinazolin-4-one Openeye Name: 7-amino-3-[2-(2,4-difluorophenyl)-2-hydroxy-1-methyl-3-(1,2,4-triazol-1-yl)propyl]-6-fluoro-quinazolin-4-one CAS Name: 7-amino-3-[3-(2,4-difluorophenyl)-3-hydroxy-4-(1,2,4-triazol-1-yl)butan-2-yl]-6-fluoro-4-quinazolinone IUPAC Name: 7-amino-3-[3-(2,4-difluorophenyl)-3-hydroxy-4-(1,2,4-triazol-1-yl)butan-2-yl]-6-fluoroquinazolin-4-one Traditional Name: 7-amino-3-[2-(2,4-difluorophenyl)-2-hydroxy-1-methyl-3-(1,2,4-triazol-1-yl)propyl]-6-fluoro-quinazolin-4-one Formula: C20H17F3N6O2 MolecularWeight: 430.38319

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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=CC(=C(C=C4C3=O)F)N

Isomeric SMILES

CC(C(CN1C=NC=N1)(C2=C(C=C(C=C2)F)F)O)N3C=NC4=CC(=C(C=C4C3=O)F)N

InChI

InChI=1S/C20H17F3N6O2/c1-11(29-10-26-18-6-17(24)16(23)5-13(18)19(29)30)20(31,7-28-9-25-8-27-28)14-3-2-12(21)4-15(14)22/h2-6,8-11,31H,7,24H2,1H3