8-ethynyl-6-phenyl-N-(2-propan-2-yloxyethyl)-4H-imidazo[1,5-a][1,4]benzodiazepine-3-carboxamide

Systemtic Name: 8-ethynyl-6-phenyl-N-(2-propan-2-yloxyethyl)-4H-imidazo[1,5-a][1,4]benzodiazepine-3-carboxamide Openeye Name: 8-ethynyl-N-(2-isopropoxyethyl)-6-phenyl-4H-imidazo[1,5-a][1,4]benzodiazepine-3-carboxamide CAS Name: 8-ethynyl-6-phenyl-N-(2-propan-2-yloxyethyl)-4H-imidazo[1,5-a][1,4]benzodiazepine-3-carboxamide IUPAC Name: 8-ethynyl-6-phenyl-N-(2-propan-2-yloxyethyl)-4H-imidazo[1,5-a][1,4]benzodiazepine-3-carboxamide Traditional Name: 8-ethynyl-N-(2-isopropoxyethyl)-6-phenyl-4H-imidazo[1,5-a][1,4]benzodiazepine-3-carboxamide Formula: C25H24N4O2 MolecularWeight: 412.48366

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OCCNC(=O)C1=C2CN=C(C3=C(N2C=N1)C=CC(=C3)C#C)C4=CC=CC=C4

Isomeric SMILES

CC(C)OCCNC(=O)C1=C2CN=C(C3=C(N2C=N1)C=CC(=C3)C#C)C4=CC=CC=C4

InChI

InChI=1S/C25H24N4O2/c1-4-18-10-11-21-20(14-18)23(19-8-6-5-7-9-19)27-15-22-24(28-16-29(21)22)25(30)26-12-13-31-17(2)3/h1,5-11,14,16-17H,12-13,15H2,2-3H3,(H,26,30)