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

Systemtic Name: 8-ethynyl-N-(3-oxidanylpropyl)-6-phenyl-4H-imidazo[1,5-a][1,4]benzodiazepine-3-carboxamide Openeye Name: 8-ethynyl-N-(3-hydroxypropyl)-6-phenyl-4H-imidazo[1,5-a][1,4]benzodiazepine-3-carboxamide CAS Name: 8-ethynyl-N-(3-hydroxypropyl)-6-phenyl-4H-imidazo[1,5-a][1,4]benzodiazepine-3-carboxamide IUPAC Name: 8-ethynyl-N-(3-hydroxypropyl)-6-phenyl-4H-imidazo[1,5-a][1,4]benzodiazepine-3-carboxamide Traditional Name: 8-ethynyl-N-(3-hydroxypropyl)-6-phenyl-4H-imidazo[1,5-a][1,4]benzodiazepine-3-carboxamide Formula: C23H20N4O2 MolecularWeight: 384.4305

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Descriptors Computed from Structure

Canonical SMILES:

C#CC1=CC2=C(C=C1)N3C=NC(=C3CN=C2C4=CC=CC=C4)C(=O)NCCCO

Isomeric SMILES

C#CC1=CC2=C(C=C1)N3C=NC(=C3CN=C2C4=CC=CC=C4)C(=O)NCCCO

InChI

InChI=1S/C23H20N4O2/c1-2-16-9-10-19-18(13-16)21(17-7-4-3-5-8-17)25-14-20-22(26-15-27(19)20)23(29)24-11-6-12-28/h1,3-5,7-10,13,15,28H,6,11-12,14H2,(H,24,29)