3-[5-(2-adamantyl)-1H-pyrazol-3-yl]-1H-benzimidazole-2-thione

Systemtic Name: 3-[5-(2-adamantyl)-1H-pyrazol-3-yl]-1H-benzimidazole-2-thione Openeye Name: 3-[5-(2-adamantyl)-1H-pyrazol-3-yl]-1H-benzimidazole-2-thione CAS Name: 3-[5-(2-adamantyl)-1H-pyrazol-3-yl]-1H-benzimidazole-2-thione IUPAC Name: 3-[5-(2-adamantyl)-1H-pyrazol-3-yl]-1H-benzimidazole-2-thione Traditional Name: 3-[5-(2-adamantyl)-1H-pyrazol-3-yl]-1H-benzimidazole-2-thione Formula: C20H22N4S MolecularWeight: 350.48048

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)C3C4=CC(=NN4)N5C6=CC=CC=C6NC5=S

Isomeric SMILES

C1C2CC3CC1CC(C2)C3C4=CC(=NN4)N5C6=CC=CC=C6NC5=S

InChI

InChI=1S/C20H22N4S/c25-20-21-15-3-1-2-4-17(15)24(20)18-10-16(22-23-18)19-13-6-11-5-12(8-13)9-14(19)7-11/h1-4,10-14,19H,5-9H2,(H,21,25)(H,22,23)