4-(3-fluoranyl-4-methoxy-phenyl)-3-(4-methylsulfonylphenyl)-5-(phenylmethoxymethyl)-1-prop-2-enyl-pyrazole

Systemtic Name: 4-(3-fluoranyl-4-methoxy-phenyl)-3-(4-methylsulfonylphenyl)-5-(phenylmethoxymethyl)-1-prop-2-enyl-pyrazole Openeye Name: 1-allyl-5-(benzyloxymethyl)-4-(3-fluoro-4-methoxy-phenyl)-3-(4-methylsulfonylphenyl)pyrazole CAS Name: 4-(3-fluoro-4-methoxyphenyl)-3-(4-methylsulfonylphenyl)-5-(phenylmethoxymethyl)-1-prop-2-enylpyrazole IUPAC Name: 4-(3-fluoro-4-methoxyphenyl)-3-(4-methylsulfonylphenyl)-5-(phenylmethoxymethyl)-1-prop-2-enylpyrazole Traditional Name: 1-allyl-5-(benzoxymethyl)-4-(3-fluoro-4-methoxy-phenyl)-3-(4-mesylphenyl)pyrazole Formula: C28H27FN2O4S MolecularWeight: 506.588383

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=C(N(N=C2C3=CC=C(C=C3)S(=O)(=O)C)CC=C)COCC4=CC=CC=C4)F

Isomeric SMILES

COC1=C(C=C(C=C1)C2=C(N(N=C2C3=CC=C(C=C3)S(=O)(=O)C)CC=C)COCC4=CC=CC=C4)F

InChI

InChI=1S/C28H27FN2O4S/c1-4-16-31-25(19-35-18-20-8-6-5-7-9-20)27(22-12-15-26(34-2)24(29)17-22)28(30-31)21-10-13-23(14-11-21)36(3,32)33/h4-15,17H,1,16,18-19H2,2-3H3