1-[2-(2-adamantyl)ethyl]-3-azanyl-5-phenyl-1,5-benzodiazepine-2,4-dione

Systemtic Name: 1-[2-(2-adamantyl)ethyl]-3-azanyl-5-phenyl-1,5-benzodiazepine-2,4-dione Openeye Name: 1-[2-(2-adamantyl)ethyl]-3-amino-5-phenyl-1,5-benzodiazepine-2,4-dione CAS Name: 1-[2-(2-adamantyl)ethyl]-3-amino-5-phenyl-1,5-benzodiazepine-2,4-dione IUPAC Name: 1-[2-(2-adamantyl)ethyl]-3-amino-5-phenyl-1,5-benzodiazepine-2,4-dione Traditional Name: 1-[2-(2-adamantyl)ethyl]-3-amino-5-phenyl-1,5-benzodiazepine-2,4-quinone Formula: C27H31N3O2 MolecularWeight: 429.55394

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)C3CCN4C5=CC=CC=C5N(C(=O)C(C4=O)N)C6=CC=CC=C6

Isomeric SMILES

C1C2CC3CC1CC(C2)C3CCN4C5=CC=CC=C5N(C(=O)C(C4=O)N)C6=CC=CC=C6

InChI

InChI=1S/C27H31N3O2/c28-25-26(31)29(11-10-22-19-13-17-12-18(15-19)16-20(22)14-17)23-8-4-5-9-24(23)30(27(25)32)21-6-2-1-3-7-21/h1-9,17-20,22,25H,10-16,28H2