7-chloranyl-6-methyl-2-(1-octadecylsulfonylpropan-2-yl)-5H-pyrazolo[1,5-b][1,2,4]triazole

Systemtic Name: 7-chloranyl-6-methyl-2-(1-octadecylsulfonylpropan-2-yl)-5H-pyrazolo[1,5-b][1,2,4]triazole Openeye Name: 7-chloro-6-methyl-2-(1-methyl-2-octadecylsulfonyl-ethyl)-5H-pyrazolo[1,5-b][1,2,4]triazole CAS Name: 7-chloro-6-methyl-2-(1-octadecylsulfonylpropan-2-yl)-5H-pyrazolo[1,5-b][1,2,4]triazole IUPAC Name: 7-chloro-6-methyl-2-(1-octadecylsulfonylpropan-2-yl)-5H-pyrazolo[1,5-b][1,2,4]triazole Traditional Name: 7-chloro-6-methyl-2-(1-methyl-2-stearylsulfonyl-ethyl)-5H-pyrazolo[1,5-b][1,2,4]triazole Formula: C26H47ClN4O2S MolecularWeight: 515.19498

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCS(=O)(=O)CC(C)C1=NN2C(=N1)C(=C(N2)C)Cl

Isomeric SMILES

CCCCCCCCCCCCCCCCCCS(=O)(=O)CC(C)C1=NN2C(=N1)C(=C(N2)C)Cl

InChI

InChI=1S/C26H47ClN4O2S/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-34(32,33)21-22(2)25-28-26-24(27)23(3)29-31(26)30-25/h22,29H,4-21H2,1-3H3