4-(4-chlorophenyl)-3-(4-methylsulfonylphenyl)-1-prop-2-ynyl-pyrazole

Systemtic Name: 4-(4-chlorophenyl)-3-(4-methylsulfonylphenyl)-1-prop-2-ynyl-pyrazole Openeye Name: 4-(4-chlorophenyl)-3-(4-methylsulfonylphenyl)-1-prop-2-ynyl-pyrazole CAS Name: 4-(4-chlorophenyl)-3-(4-methylsulfonylphenyl)-1-prop-2-ynylpyrazole IUPAC Name: 4-(4-chlorophenyl)-3-(4-methylsulfonylphenyl)-1-prop-2-ynylpyrazole Traditional Name: 4-(4-chlorophenyl)-3-(4-mesylphenyl)-1-propargyl-pyrazole Formula: C19H15ClN2O2S MolecularWeight: 370.8526

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)C2=NN(C=C2C3=CC=C(C=C3)Cl)CC#C

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)C2=NN(C=C2C3=CC=C(C=C3)Cl)CC#C

InChI

InChI=1S/C19H15ClN2O2S/c1-3-12-22-13-18(14-4-8-16(20)9-5-14)19(21-22)15-6-10-17(11-7-15)25(2,23)24/h1,4-11,13H,12H2,2H3