1-[4-[2,5-bis(fluoranyl)phenyl]sulfonylpiperazin-1-yl]-3-(4-ethylphenyl)propan-1-one

Systemtic Name: 1-[4-[2,5-bis(fluoranyl)phenyl]sulfonylpiperazin-1-yl]-3-(4-ethylphenyl)propan-1-one Openeye Name: 1-[4-(2,5-difluorophenyl)sulfonylpiperazin-1-yl]-3-(4-ethylphenyl)propan-1-one CAS Name: 1-[4-(2,5-difluorophenyl)sulfonyl-1-piperazinyl]-3-(4-ethylphenyl)-1-propanone IUPAC Name: 1-[4-(2,5-difluorophenyl)sulfonylpiperazin-1-yl]-3-(4-ethylphenyl)propan-1-one Traditional Name: 1-[4-(2,5-difluorophenyl)sulfonylpiperazino]-3-(4-ethylphenyl)propan-1-one Formula: C21H24F2N2O3S MolecularWeight: 422.488666

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H24F2N2O3S/c1-2-16-3-5-17(6-4-16)7-10-21(26)24-11-13-25(14-12-24)29(27,28)20-15-18(22)8-9-19(20)23/h3-6,8-9,15H,2,7,10-14H2,1H3