3-(3,3-dimethylbut-1-ynyl)-5-methyl-4H-imidazo[1,5-a][1,4]benzodiazepin-6-one

Systemtic Name: 3-(3,3-dimethylbut-1-ynyl)-5-methyl-4H-imidazo[1,5-a][1,4]benzodiazepin-6-one Openeye Name: 3-(3,3-dimethylbut-1-ynyl)-5-methyl-4H-imidazo[1,5-a][1,4]benzodiazepin-6-one CAS Name: 3-(3,3-dimethylbut-1-ynyl)-5-methyl-4H-imidazo[1,5-a][1,4]benzodiazepin-6-one IUPAC Name: 3-(3,3-dimethylbut-1-ynyl)-5-methyl-4H-imidazo[1,5-a][1,4]benzodiazepin-6-one Traditional Name: 3-(3,3-dimethylbut-1-ynyl)-5-methyl-4H-imidazo[1,5-a][1,4]benzodiazepin-6-one Formula: C18H19N3O MolecularWeight: 293.36296

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C#CC1=C2CN(C(=O)C3=CC=CC=C3N2C=N1)C

Isomeric SMILES

CC(C)(C)C#CC1=C2CN(C(=O)C3=CC=CC=C3N2C=N1)C

InChI

InChI=1S/C18H19N3O/c1-18(2,3)10-9-14-16-11-20(4)17(22)13-7-5-6-8-15(13)21(16)12-19-14/h5-8,12H,11H2,1-4H3