3-(4,4-diethoxythian-3-yl)oxy-4-(4-fluorophenyl)-5-(4-methylsulfonylphenyl)-1H-pyrazole

Systemtic Name: 3-(4,4-diethoxythian-3-yl)oxy-4-(4-fluorophenyl)-5-(4-methylsulfonylphenyl)-1H-pyrazole Openeye Name: 3-(4,4-diethoxytetrahydrothiopyran-3-yl)oxy-4-(4-fluorophenyl)-5-(4-methylsulfonylphenyl)-1H-pyrazole CAS Name: 3-[(4,4-diethoxy-3-thianyl)oxy]-4-(4-fluorophenyl)-5-(4-methylsulfonylphenyl)-1H-pyrazole IUPAC Name: 3-(4,4-diethoxythian-3-yl)oxy-4-(4-fluorophenyl)-5-(4-methylsulfonylphenyl)-1H-pyrazole Traditional Name: 3-(4,4-diethoxytetrahydrothiopyran-3-yl)oxy-4-(4-fluorophenyl)-5-(4-mesylphenyl)-1H-pyrazole Formula: C25H29FN2O5S2 MolecularWeight: 520.636563

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1(CCSCC1OC2=NNC(=C2C3=CC=C(C=C3)F)C4=CC=C(C=C4)S(=O)(=O)C)OCC

Isomeric SMILES

CCOC1(CCSCC1OC2=NNC(=C2C3=CC=C(C=C3)F)C4=CC=C(C=C4)S(=O)(=O)C)OCC

InChI

InChI=1S/C25H29FN2O5S2/c1-4-31-25(32-5-2)14-15-34-16-21(25)33-24-22(17-6-10-19(26)11-7-17)23(27-28-24)18-8-12-20(13-9-18)35(3,29)30/h6-13,21H,4-5,14-16H2,1-3H3,(H,27,28)