4-bromanyl-3-(4-methylsulfanylphenyl)-1-(triphenylmethyl)pyrazole

Systemtic Name: 4-bromanyl-3-(4-methylsulfanylphenyl)-1-(triphenylmethyl)pyrazole Openeye Name: 4-bromo-3-(4-methylsulfanylphenyl)-1-trityl-pyrazole CAS Name: 4-bromo-3-[4-(methylthio)phenyl]-1-(triphenylmethyl)pyrazole IUPAC Name: 4-bromo-3-(4-methylsulfanylphenyl)-1-tritylpyrazole Traditional Name: 4-bromo-3-[4-(methylthio)phenyl]-1-trityl-pyrazole Formula: C29H23BrN2S MolecularWeight: 511.47532

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)C2=NN(C=C2Br)C(C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CSC1=CC=C(C=C1)C2=NN(C=C2Br)C(C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C29H23BrN2S/c1-33-26-19-17-22(18-20-26)28-27(30)21-32(31-28)29(23-11-5-2-6-12-23,24-13-7-3-8-14-24)25-15-9-4-10-16-25/h2-21H,1H3