3-bromanyl-7-(4-methylphenyl)-2-phenyl-6-(phenylsulfonyl)pyrazolo[1,5-a]pyrimidine

Systemtic Name: 3-bromanyl-7-(4-methylphenyl)-2-phenyl-6-(phenylsulfonyl)pyrazolo[1,5-a]pyrimidine Openeye Name: 6-(benzenesulfonyl)-3-bromo-2-phenyl-7-(p-tolyl)pyrazolo[1,5-a]pyrimidine CAS Name: 6-(benzenesulfonyl)-3-bromo-7-(4-methylphenyl)-2-phenylpyrazolo[1,5-a]pyrimidine IUPAC Name: 6-(benzenesulfonyl)-3-bromo-7-(4-methylphenyl)-2-phenylpyrazolo[1,5-a]pyrimidine Traditional Name: 6-besyl-3-bromo-2-phenyl-7-(p-tolyl)pyrazolo[1,5-a]pyrimidine Formula: C25H18BrN3O2S MolecularWeight: 504.39832

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(C=NC3=C(C(=NN23)C4=CC=CC=C4)Br)S(=O)(=O)C5=CC=CC=C5

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(C=NC3=C(C(=NN23)C4=CC=CC=C4)Br)S(=O)(=O)C5=CC=CC=C5

InChI

InChI=1S/C25H18BrN3O2S/c1-17-12-14-19(15-13-17)24-21(32(30,31)20-10-6-3-7-11-20)16-27-25-22(26)23(28-29(24)25)18-8-4-2-5-9-18/h2-16H,1H3