(E)-1-[4-(2-fluorophenyl)sulfonylpiperazin-1-yl]-3-(2-methoxy-5-methyl-phenyl)prop-2-en-1-one

Systemtic Name: (E)-1-[4-(2-fluorophenyl)sulfonylpiperazin-1-yl]-3-(2-methoxy-5-methyl-phenyl)prop-2-en-1-one Openeye Name: (E)-1-[4-(2-fluorophenyl)sulfonylpiperazin-1-yl]-3-(2-methoxy-5-methyl-phenyl)prop-2-en-1-one CAS Name: (E)-1-[4-(2-fluorophenyl)sulfonyl-1-piperazinyl]-3-(2-methoxy-5-methylphenyl)-2-propen-1-one IUPAC Name: (E)-1-[4-(2-fluorophenyl)sulfonylpiperazin-1-yl]-3-(2-methoxy-5-methylphenyl)prop-2-en-1-one Traditional Name: (E)-1-[4-(2-fluorophenyl)sulfonylpiperazino]-3-(2-methoxy-5-methyl-phenyl)prop-2-en-1-one Formula: C21H23FN2O4S MolecularWeight: 418.481723

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)C=CC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC=C3F

Isomeric SMILES

CC1=CC(=C(C=C1)OC)/C=C/C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC=C3F

InChI

InChI=1S/C21H23FN2O4S/c1-16-7-9-19(28-2)17(15-16)8-10-21(25)23-11-13-24(14-12-23)29(26,27)20-6-4-3-5-18(20)22/h3-10,15H,11-14H2,1-2H3/b10-8+