4-(2-adamantyl)-1,3-dihydro-1,5-benzodiazepine-2-thione

Systemtic Name: 4-(2-adamantyl)-1,3-dihydro-1,5-benzodiazepine-2-thione Openeye Name: 4-(2-adamantyl)-1,3-dihydro-1,5-benzodiazepine-2-thione CAS Name: 4-(2-adamantyl)-1,3-dihydro-1,5-benzodiazepine-2-thione IUPAC Name: 4-(2-adamantyl)-1,3-dihydro-1,5-benzodiazepine-2-thione Traditional Name: 4-(2-adamantyl)-1,3-dihydro-1,5-benzodiazepine-2-thione Formula: C19H22N2S MolecularWeight: 310.45638

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)C3C4=NC5=CC=CC=C5NC(=S)C4

Isomeric SMILES

C1C2CC3CC1CC(C2)C3C4=NC5=CC=CC=C5NC(=S)C4

InChI

InChI=1S/C19H22N2S/c22-18-10-17(20-15-3-1-2-4-16(15)21-18)19-13-6-11-5-12(8-13)9-14(19)7-11/h1-4,11-14,19H,5-10H2,(H,21,22)