7-bromanyl-6-tert-butyl-7-(4-methoxyphenyl)sulfanyl-2-phenyl-pyrazolo[1,5-b][1,2,4]triazole

Systemtic Name: 7-bromanyl-6-tert-butyl-7-(4-methoxyphenyl)sulfanyl-2-phenyl-pyrazolo[1,5-b][1,2,4]triazole Openeye Name: 7-bromo-6-tert-butyl-7-(4-methoxyphenyl)sulfanyl-2-phenyl-pyrazolo[1,5-b][1,2,4]triazole CAS Name: 7-bromo-6-tert-butyl-7-[(4-methoxyphenyl)thio]-2-phenylpyrazolo[1,5-b][1,2,4]triazole IUPAC Name: 7-bromo-6-tert-butyl-7-(4-methoxyphenyl)sulfanyl-2-phenylpyrazolo[1,5-b][1,2,4]triazole Traditional Name: 7-bromo-6-tert-butyl-7-[(4-methoxyphenyl)thio]-2-phenyl-pyrazolo[1,5-b][1,2,4]triazole Formula: C21H21BrN4OS MolecularWeight: 457.38664

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NN2C(=NC(=N2)C3=CC=CC=C3)C1(SC4=CC=C(C=C4)OC)Br

Isomeric SMILES

CC(C)(C)C1=NN2C(=NC(=N2)C3=CC=CC=C3)C1(SC4=CC=C(C=C4)OC)Br

InChI

InChI=1S/C21H21BrN4OS/c1-20(2,3)18-21(22,28-16-12-10-15(27-4)11-13-16)19-23-17(24-26(19)25-18)14-8-6-5-7-9-14/h5-13H,1-4H3