3-(3-butylsulfanyl-5,5-diethyl-1H-1,2,4-triazol-2-yl)thiolane 1,1-dioxide

Systemtic Name: 3-(3-butylsulfanyl-5,5-diethyl-1H-1,2,4-triazol-2-yl)thiolane 1,1-dioxide Openeye Name: 3-(3-butylsulfanyl-5,5-diethyl-1H-1,2,4-triazol-2-yl)thiolane 1,1-dioxide CAS Name: 3-[3-(butylthio)-5,5-diethyl-1H-1,2,4-triazol-2-yl]thiolane 1,1-dioxide IUPAC Name: 3-(3-butylsulfanyl-5,5-diethyl-1H-1,2,4-triazol-2-yl)thiolane 1,1-dioxide Traditional Name: 3-[3-(butylthio)-5,5-diethyl-1H-1,2,4-triazol-2-yl]sulfolane Formula: C14H27N3O2S2 MolecularWeight: 333.51308

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSC1=NC(NN1C2CCS(=O)(=O)C2)(CC)CC

Isomeric SMILES

CCCCSC1=NC(NN1C2CCS(=O)(=O)C2)(CC)CC

InChI

InChI=1S/C14H27N3O2S2/c1-4-7-9-20-13-15-14(5-2,6-3)16-17(13)12-8-10-21(18,19)11-12/h12,16H,4-11H2,1-3H3