8-fluoranyl-5-methyl-3-(3-methyl-3-oxidanyl-but-1-ynyl)-4H-imidazo[1,5-a][1,4]benzodiazepin-6-one

Systemtic Name: 8-fluoranyl-5-methyl-3-(3-methyl-3-oxidanyl-but-1-ynyl)-4H-imidazo[1,5-a][1,4]benzodiazepin-6-one Openeye Name: 8-fluoro-3-(3-hydroxy-3-methyl-but-1-ynyl)-5-methyl-4H-imidazo[1,5-a][1,4]benzodiazepin-6-one CAS Name: 8-fluoro-3-(3-hydroxy-3-methylbut-1-ynyl)-5-methyl-4H-imidazo[1,5-a][1,4]benzodiazepin-6-one IUPAC Name: 8-fluoro-3-(3-hydroxy-3-methylbut-1-ynyl)-5-methyl-4H-imidazo[1,5-a][1,4]benzodiazepin-6-one Traditional Name: 8-fluoro-3-(3-hydroxy-3-methyl-but-1-ynyl)-5-methyl-4H-imidazo[1,5-a][1,4]benzodiazepin-6-one Formula: C17H16FN3O2 MolecularWeight: 313.326243

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C#CC1=C2CN(C(=O)C3=C(N2C=N1)C=CC(=C3)F)C)O

Isomeric SMILES

CC(C)(C#CC1=C2CN(C(=O)C3=C(N2C=N1)C=CC(=C3)F)C)O

InChI

InChI=1S/C17H16FN3O2/c1-17(2,23)7-6-13-15-9-20(3)16(22)12-8-11(18)4-5-14(12)21(15)10-19-13/h4-5,8,10,23H,9H2,1-3H3