4-tert-butyl-3-cyclododecyl-5-octylsulfanyl-1,2,4-triazole

Systemtic Name: 4-tert-butyl-3-cyclododecyl-5-octylsulfanyl-1,2,4-triazole Openeye Name: 4-tert-butyl-3-cyclododecyl-5-octylsulfanyl-1,2,4-triazole CAS Name: 4-tert-butyl-3-cyclododecyl-5-(octylthio)-1,2,4-triazole IUPAC Name: 4-tert-butyl-3-cyclododecyl-5-octylsulfanyl-1,2,4-triazole Traditional Name: 4-tert-butyl-3-cyclododecyl-5-(octylthio)-1,2,4-triazole Formula: C26H49N3S MolecularWeight: 435.75236

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCSC1=NN=C(N1C(C)(C)C)C2CCCCCCCCCCC2

Isomeric SMILES

CCCCCCCCSC1=NN=C(N1C(C)(C)C)C2CCCCCCCCCCC2

InChI

InChI=1S/C26H49N3S/c1-5-6-7-8-16-19-22-30-25-28-27-24(29(25)26(2,3)4)23-20-17-14-12-10-9-11-13-15-18-21-23/h23H,5-22H2,1-4H3