2-(1-adamantyl)-4,5-diphenyl-1,2,4-triazole-3-thione

Systemtic Name: 2-(1-adamantyl)-4,5-diphenyl-1,2,4-triazole-3-thione Openeye Name: 2-(1-adamantyl)-4,5-diphenyl-1,2,4-triazole-3-thione CAS Name: 2-(1-adamantyl)-4,5-diphenyl-1,2,4-triazole-3-thione IUPAC Name: 2-(1-adamantyl)-4,5-diphenyl-1,2,4-triazole-3-thione Traditional Name: 2-(1-adamantyl)-4,5-diphenyl-1,2,4-triazole-3-thione Formula: C24H25N3S MolecularWeight: 387.5404

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)N4C(=S)N(C(=N4)C5=CC=CC=C5)C6=CC=CC=C6

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)N4C(=S)N(C(=N4)C5=CC=CC=C5)C6=CC=CC=C6

InChI

InChI=1S/C24H25N3S/c28-23-26(21-9-5-2-6-10-21)22(20-7-3-1-4-8-20)25-27(23)24-14-17-11-18(15-24)13-19(12-17)16-24/h1-10,17-19H,11-16H2