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

Systemtic Name: 8-ethynyl-N-(2-methoxyethyl)-6-phenyl-4H-imidazo[1,5-a][1,4]benzodiazepine-3-carboxamide hydrochloride Openeye Name: 8-ethynyl-N-(2-methoxyethyl)-6-phenyl-4H-imidazo[1,5-a][1,4]benzodiazepine-3-carboxamide hydrochloride CAS Name: 8-ethynyl-N-(2-methoxyethyl)-6-phenyl-4H-imidazo[1,5-a][1,4]benzodiazepine-3-carboxamide hydrochloride IUPAC Name: 8-ethynyl-N-(2-methoxyethyl)-6-phenyl-4H-imidazo[1,5-a][1,4]benzodiazepine-3-carboxamide hydrochloride Traditional Name: 8-ethynyl-N-(2-methoxyethyl)-6-phenyl-4H-imidazo[1,5-a][1,4]benzodiazepine-3-carboxamide hydrochloride Formula: C23H21ClN4O2 MolecularWeight: 420.89144

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Descriptors Computed from Structure

Canonical SMILES:

COCCNC(=O)C1=C2CN=C(C3=C(N2C=N1)C=CC(=C3)C#C)C4=CC=CC=C4.Cl

Isomeric SMILES

COCCNC(=O)C1=C2CN=C(C3=C(N2C=N1)C=CC(=C3)C#C)C4=CC=CC=C4.Cl

InChI

InChI=1S/C23H20N4O2.ClH/c1-3-16-9-10-19-18(13-16)21(17-7-5-4-6-8-17)25-14-20-22(26-15-27(19)20)23(28)24-11-12-29-2;/h1,4-10,13,15H,11-12,14H2,2H3,(H,24,28);1H