4-(4-bromanyl-3,5-diphenyl-pyrazol-1-yl)-2-methylsulfonyl-pyrimidine

Systemtic Name: 4-(4-bromanyl-3,5-diphenyl-pyrazol-1-yl)-2-methylsulfonyl-pyrimidine Openeye Name: 4-(4-bromo-3,5-diphenyl-pyrazol-1-yl)-2-methylsulfonyl-pyrimidine CAS Name: 4-(4-bromo-3,5-diphenyl-1-pyrazolyl)-2-methylsulfonylpyrimidine IUPAC Name: 4-(4-bromo-3,5-diphenylpyrazol-1-yl)-2-methylsulfonylpyrimidine Traditional Name: 4-(4-bromo-3,5-diphenyl-pyrazol-1-yl)-2-mesyl-pyrimidine Formula: C20H15BrN4O2S MolecularWeight: 455.3277

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=NC=CC(=N1)N2C(=C(C(=N2)C3=CC=CC=C3)Br)C4=CC=CC=C4

Isomeric SMILES

CS(=O)(=O)C1=NC=CC(=N1)N2C(=C(C(=N2)C3=CC=CC=C3)Br)C4=CC=CC=C4

InChI

InChI=1S/C20H15BrN4O2S/c1-28(26,27)20-22-13-12-16(23-20)25-19(15-10-6-3-7-11-15)17(21)18(24-25)14-8-4-2-5-9-14/h2-13H,1H3