(E)-3-(4-ethylphenyl)-1-[4-(4-fluorophenyl)sulfonylpiperazin-1-yl]prop-2-en-1-one

Systemtic Name: (E)-3-(4-ethylphenyl)-1-[4-(4-fluorophenyl)sulfonylpiperazin-1-yl]prop-2-en-1-one Openeye Name: (E)-3-(4-ethylphenyl)-1-[4-(4-fluorophenyl)sulfonylpiperazin-1-yl]prop-2-en-1-one CAS Name: (E)-3-(4-ethylphenyl)-1-[4-(4-fluorophenyl)sulfonyl-1-piperazinyl]-2-propen-1-one IUPAC Name: (E)-3-(4-ethylphenyl)-1-[4-(4-fluorophenyl)sulfonylpiperazin-1-yl]prop-2-en-1-one Traditional Name: (E)-3-(4-ethylphenyl)-1-[4-(4-fluorophenyl)sulfonylpiperazino]prop-2-en-1-one Formula: C21H23FN2O3S MolecularWeight: 402.482323

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C=CC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)F

Isomeric SMILES

CCC1=CC=C(C=C1)/C=C/C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C21H23FN2O3S/c1-2-17-3-5-18(6-4-17)7-12-21(25)23-13-15-24(16-14-23)28(26,27)20-10-8-19(22)9-11-20/h3-12H,2,13-16H2,1H3/b12-7+