3-(4-methylsulfonylphenyl)-4-phenyl-1-prop-1-ynyl-pyrazole

Systemtic Name: 3-(4-methylsulfonylphenyl)-4-phenyl-1-prop-1-ynyl-pyrazole Openeye Name: 3-(4-methylsulfonylphenyl)-4-phenyl-1-prop-1-ynyl-pyrazole CAS Name: 3-(4-methylsulfonylphenyl)-4-phenyl-1-prop-1-ynylpyrazole IUPAC Name: 3-(4-methylsulfonylphenyl)-4-phenyl-1-prop-1-ynylpyrazole Traditional Name: 3-(4-mesylphenyl)-4-phenyl-1-prop-1-ynyl-pyrazole Formula: C19H16N2O2S MolecularWeight: 336.40754

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Descriptors Computed from Structure

Canonical SMILES:

CC#CN1C=C(C(=N1)C2=CC=C(C=C2)S(=O)(=O)C)C3=CC=CC=C3

Isomeric SMILES

CC#CN1C=C(C(=N1)C2=CC=C(C=C2)S(=O)(=O)C)C3=CC=CC=C3

InChI

InChI=1S/C19H16N2O2S/c1-3-13-21-14-18(15-7-5-4-6-8-15)19(20-21)16-9-11-17(12-10-16)24(2,22)23/h4-12,14H,1-2H3