7-chloranyl-3-(3,3-dicyclopropyl-3-oxidanyl-prop-1-ynyl)-5-methyl-4H-imidazo[1,5-a][1,4]benzodiazepin-6-one

Systemtic Name: 7-chloranyl-3-(3,3-dicyclopropyl-3-oxidanyl-prop-1-ynyl)-5-methyl-4H-imidazo[1,5-a][1,4]benzodiazepin-6-one Openeye Name: 7-chloro-3-(3,3-dicyclopropyl-3-hydroxy-prop-1-ynyl)-5-methyl-4H-imidazo[1,5-a][1,4]benzodiazepin-6-one CAS Name: 7-chloro-3-(3,3-dicyclopropyl-3-hydroxyprop-1-ynyl)-5-methyl-4H-imidazo[1,5-a][1,4]benzodiazepin-6-one IUPAC Name: 7-chloro-3-(3,3-dicyclopropyl-3-hydroxyprop-1-ynyl)-5-methyl-4H-imidazo[1,5-a][1,4]benzodiazepin-6-one Traditional Name: 7-chloro-3-(3,3-dicyclopropyl-3-hydroxy-prop-1-ynyl)-5-methyl-4H-imidazo[1,5-a][1,4]benzodiazepin-6-one Formula: C21H20ClN3O2 MolecularWeight: 381.8554

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Descriptors Computed from Structure

Canonical SMILES:

CN1CC2=C(N=CN2C3=C(C1=O)C(=CC=C3)Cl)C#CC(C4CC4)(C5CC5)O

Isomeric SMILES

CN1CC2=C(N=CN2C3=C(C1=O)C(=CC=C3)Cl)C#CC(C4CC4)(C5CC5)O

InChI

InChI=1S/C21H20ClN3O2/c1-24-11-18-16(9-10-21(27,13-5-6-13)14-7-8-14)23-12-25(18)17-4-2-3-15(22)19(17)20(24)26/h2-4,12-14,27H,5-8,11H2,1H3