4-cyclooctyl-3-cyclopropyl-1H-1,2,4-triazole-5-thione

Systemtic Name: 4-cyclooctyl-3-cyclopropyl-1H-1,2,4-triazole-5-thione Openeye Name: 4-cyclooctyl-3-cyclopropyl-1H-1,2,4-triazole-5-thione CAS Name: 4-cyclooctyl-3-cyclopropyl-1H-1,2,4-triazole-5-thione IUPAC Name: 4-cyclooctyl-3-cyclopropyl-1H-1,2,4-triazole-5-thione Traditional Name: 4-cyclooctyl-3-cyclopropyl-1H-1,2,4-triazole-5-thione Formula: C13H21N3S MolecularWeight: 251.39094

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CCC1)N2C(=NNC2=S)C3CC3

Isomeric SMILES

C1CCCC(CCC1)N2C(=NNC2=S)C3CC3

InChI

InChI=1S/C13H21N3S/c17-13-15-14-12(10-8-9-10)16(13)11-6-4-2-1-3-5-7-11/h10-11H,1-9H2,(H,15,17)