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

Systemtic Name: 3-(1-adamantyl)-4-ethyl-1H-1,2,4-triazole-5-thione Openeye Name: 3-(1-adamantyl)-4-ethyl-1H-1,2,4-triazole-5-thione CAS Name: 3-(1-adamantyl)-4-ethyl-1H-1,2,4-triazole-5-thione IUPAC Name: 3-(1-adamantyl)-4-ethyl-1H-1,2,4-triazole-5-thione Traditional Name: 3-(1-adamantyl)-4-ethyl-1H-1,2,4-triazole-5-thione Formula: C14H21N3S MolecularWeight: 263.40164

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NNC1=S)C23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CCN1C(=NNC1=S)C23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C14H21N3S/c1-2-17-12(15-16-13(17)18)14-6-9-3-10(7-14)5-11(4-9)8-14/h9-11H,2-8H2,1H3,(H,16,18)