2-(1-adamantyl)-4,5-bis(4-bromophenyl)-3H-1,2,4-triazole

Systemtic Name: 2-(1-adamantyl)-4,5-bis(4-bromophenyl)-3H-1,2,4-triazole Openeye Name: 2-(1-adamantyl)-4,5-bis(4-bromophenyl)-3H-1,2,4-triazole CAS Name: 2-(1-adamantyl)-4,5-bis(4-bromophenyl)-3H-1,2,4-triazole IUPAC Name: 2-(1-adamantyl)-4,5-bis(4-bromophenyl)-3H-1,2,4-triazole Traditional Name: 2-(1-adamantyl)-4,5-bis(4-bromophenyl)-3H-1,2,4-triazole Formula: C24H25Br2N3 MolecularWeight: 515.2834

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)N4CN(C(=N4)C5=CC=C(C=C5)Br)C6=CC=C(C=C6)Br

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)N4CN(C(=N4)C5=CC=C(C=C5)Br)C6=CC=C(C=C6)Br

InChI

InChI=1S/C24H25Br2N3/c25-20-3-1-19(2-4-20)23-27-29(15-28(23)22-7-5-21(26)6-8-22)24-12-16-9-17(13-24)11-18(10-16)14-24/h1-8,16-18H,9-15H2