tert-butyl 5-methyl-6-oxidanylidene-8-(2-trimethylsilylethynyl)-3a,4-dihydro-1H-imidazo[1,5-a][1,4]benzodiazepine-3-carboxylate

Systemtic Name: tert-butyl 5-methyl-6-oxidanylidene-8-(2-trimethylsilylethynyl)-3a,4-dihydro-1H-imidazo[1,5-a][1,4]benzodiazepine-3-carboxylate Openeye Name: tert-butyl 5-methyl-6-oxo-8-(2-trimethylsilylethynyl)-3a,4-dihydro-1H-imidazo[1,5-a][1,4]benzodiazepine-3-carboxylate CAS Name: 5-methyl-6-oxo-8-(2-trimethylsilylethynyl)-3a,4-dihydro-1H-imidazo[1,5-a][1,4]benzodiazepine-3-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 5-methyl-6-oxo-8-(2-trimethylsilylethynyl)-3a,4-dihydro-1H-imidazo[1,5-a][1,4]benzodiazepine-3-carboxylate Traditional Name: 6-keto-5-methyl-8-(2-trimethylsilylethynyl)-3a,4-dihydro-1H-imidazo[1,5-a][1,4]benzodiazepine-3-carboxylic acid tert-butyl ester Formula: C22H29N3O3Si MolecularWeight: 411.56946

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1=NCN2C1CN(C(=O)C3=C2C=CC(=C3)C#C[Si](C)(C)C)C

Isomeric SMILES

CC(C)(C)OC(=O)C1=NCN2C1CN(C(=O)C3=C2C=CC(=C3)C#C[Si](C)(C)C)C

InChI

InChI=1S/C22H29N3O3Si/c1-22(2,3)28-21(27)19-18-13-24(4)20(26)16-12-15(10-11-29(5,6)7)8-9-17(16)25(18)14-23-19/h8-9,12,18H,13-14H2,1-7H3