3-(1-adamantyl)-4-[[(2S)-oxolan-2-yl]methyl]-1H-1,2,4-triazole-5-thione

Systemtic Name: 3-(1-adamantyl)-4-[[(2S)-oxolan-2-yl]methyl]-1H-1,2,4-triazole-5-thione Openeye Name: 3-(1-adamantyl)-4-[[(2S)-tetrahydrofuran-2-yl]methyl]-1H-1,2,4-triazole-5-thione CAS Name: 3-(1-adamantyl)-4-[[(2S)-2-oxolanyl]methyl]-1H-1,2,4-triazole-5-thione IUPAC Name: 3-(1-adamantyl)-4-[[(2S)-oxolan-2-yl]methyl]-1H-1,2,4-triazole-5-thione Traditional Name: 3-(1-adamantyl)-4-[[(2S)-tetrahydrofuran-2-yl]methyl]-1H-1,2,4-triazole-5-thione Formula: C17H25N3OS MolecularWeight: 319.4649

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CN2C(=NNC2=S)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

C1C[C@H](OC1)CN2C(=NNC2=S)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C17H25N3OS/c22-16-19-18-15(20(16)10-14-2-1-3-21-14)17-7-11-4-12(8-17)6-13(5-11)9-17/h11-14H,1-10H2,(H,19,22)/t11?,12?,13?,14-,17?/m0/s1