3-(2,4-dimethoxyphenyl)-1-[4-(3-fluorophenyl)sulfonylpiperazin-1-yl]prop-2-en-1-one

Systemtic Name: 3-(2,4-dimethoxyphenyl)-1-[4-(3-fluorophenyl)sulfonylpiperazin-1-yl]prop-2-en-1-one Openeye Name: 3-(2,4-dimethoxyphenyl)-1-[4-(3-fluorophenyl)sulfonylpiperazin-1-yl]prop-2-en-1-one CAS Name: 3-(2,4-dimethoxyphenyl)-1-[4-(3-fluorophenyl)sulfonyl-1-piperazinyl]-2-propen-1-one IUPAC Name: 3-(2,4-dimethoxyphenyl)-1-[4-(3-fluorophenyl)sulfonylpiperazin-1-yl]prop-2-en-1-one Traditional Name: 3-(2,4-dimethoxyphenyl)-1-[4-(3-fluorophenyl)sulfonylpiperazino]prop-2-en-1-one Formula: C21H23FN2O5S MolecularWeight: 434.481123

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)C=CC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC(=C3)F)OC

Isomeric SMILES

COC1=CC(=C(C=C1)C=CC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC(=C3)F)OC

InChI

InChI=1S/C21H23FN2O5S/c1-28-18-8-6-16(20(15-18)29-2)7-9-21(25)23-10-12-24(13-11-23)30(26,27)19-5-3-4-17(22)14-19/h3-9,14-15H,10-13H2,1-2H3