2-azanyl-5-[4-[bis(fluoranyl)methoxy]phenyl]-5-[3-[1,4-bis(oxidanyl)but-2-ynyl]phenyl]-3-methyl-imidazol-4-one

Systemtic Name: 2-azanyl-5-[4-[bis(fluoranyl)methoxy]phenyl]-5-[3-[1,4-bis(oxidanyl)but-2-ynyl]phenyl]-3-methyl-imidazol-4-one Openeye Name: 2-amino-5-[4-(difluoromethoxy)phenyl]-5-[3-(1,4-dihydroxybut-2-ynyl)phenyl]-3-methyl-imidazol-4-one CAS Name: 2-amino-5-[4-(difluoromethoxy)phenyl]-5-[3-(1,4-dihydroxybut-2-ynyl)phenyl]-3-methyl-4-imidazolone IUPAC Name: 2-amino-5-[4-(difluoromethoxy)phenyl]-5-[3-(1,4-dihydroxybut-2-ynyl)phenyl]-3-methylimidazol-4-one Traditional Name: 2-amino-5-[4-(difluoromethoxy)phenyl]-5-[3-(1,4-dihydroxybut-2-ynyl)phenyl]-3-methyl-2-imidazolin-4-one Formula: C21H19F2N3O4 MolecularWeight: 415.390066

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C(N=C1N)(C2=CC=C(C=C2)OC(F)F)C3=CC(=CC=C3)C(C#CCO)O

Isomeric SMILES

CN1C(=O)C(N=C1N)(C2=CC=C(C=C2)OC(F)F)C3=CC(=CC=C3)C(C#CCO)O

InChI

InChI=1S/C21H19F2N3O4/c1-26-18(29)21(25-20(26)24,14-7-9-16(10-8-14)30-19(22)23)15-5-2-4-13(12-15)17(28)6-3-11-27/h2,4-5,7-10,12,17,19,27-28H,11H2,1H3,(H2,24,25)