3-(5-tert-butyl-2-methyl-pyrazol-3-yl)-5-[1-(cyclopropylmethylsulfonyl)propan-2-yl]-1H-1,2,4-triazole

Systemtic Name: 3-(5-tert-butyl-2-methyl-pyrazol-3-yl)-5-[1-(cyclopropylmethylsulfonyl)propan-2-yl]-1H-1,2,4-triazole Openeye Name: 3-(5-tert-butyl-2-methyl-pyrazol-3-yl)-5-[2-(cyclopropylmethylsulfonyl)-1-methyl-ethyl]-1H-1,2,4-triazole CAS Name: 3-(5-tert-butyl-2-methyl-3-pyrazolyl)-5-[1-(cyclopropylmethylsulfonyl)propan-2-yl]-1H-1,2,4-triazole IUPAC Name: 3-(5-tert-butyl-2-methylpyrazol-3-yl)-5-[1-(cyclopropylmethylsulfonyl)propan-2-yl]-1H-1,2,4-triazole Traditional Name: 3-(5-tert-butyl-2-methyl-pyrazol-3-yl)-5-[2-(cyclopropylmethylsulfonyl)-1-methyl-ethyl]-1H-1,2,4-triazole Formula: C17H27N5O2S MolecularWeight: 365.49358

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Descriptors Computed from Structure

Canonical SMILES:

CC(CS(=O)(=O)CC1CC1)C2=NC(=NN2)C3=CC(=NN3C)C(C)(C)C

Isomeric SMILES

CC(CS(=O)(=O)CC1CC1)C2=NC(=NN2)C3=CC(=NN3C)C(C)(C)C

InChI

InChI=1S/C17H27N5O2S/c1-11(9-25(23,24)10-12-6-7-12)15-18-16(20-19-15)13-8-14(17(2,3)4)21-22(13)5/h8,11-12H,6-7,9-10H2,1-5H3,(H,18,19,20)