2-[1-[2-[2,4-bis(fluoranyl)phenyl]oxiran-2-yl]ethyl]-4-(4-propan-2-ylphenyl)-1,2,4-triazol-3-one

Systemtic Name: 2-[1-[2-[2,4-bis(fluoranyl)phenyl]oxiran-2-yl]ethyl]-4-(4-propan-2-ylphenyl)-1,2,4-triazol-3-one Openeye Name: 2-[1-[2-(2,4-difluorophenyl)oxiran-2-yl]ethyl]-4-(4-isopropylphenyl)-1,2,4-triazol-3-one CAS Name: 2-[1-[2-(2,4-difluorophenyl)-2-oxiranyl]ethyl]-4-(4-propan-2-ylphenyl)-1,2,4-triazol-3-one IUPAC Name: 2-[1-[2-(2,4-difluorophenyl)oxiran-2-yl]ethyl]-4-(4-propan-2-ylphenyl)-1,2,4-triazol-3-one Traditional Name: 2-[1-[2-(2,4-difluorophenyl)oxiran-2-yl]ethyl]-4-p-cumenyl-1,2,4-triazol-3-one Formula: C21H21F2N3O2 MolecularWeight: 385.407146

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)N2C=NN(C2=O)C(C)C3(CO3)C4=C(C=C(C=C4)F)F

Isomeric SMILES

CC(C)C1=CC=C(C=C1)N2C=NN(C2=O)C(C)C3(CO3)C4=C(C=C(C=C4)F)F

InChI

InChI=1S/C21H21F2N3O2/c1-13(2)15-4-7-17(8-5-15)25-12-24-26(20(25)27)14(3)21(11-28-21)18-9-6-16(22)10-19(18)23/h4-10,12-14H,11H2,1-3H3