(E)-1-(4-ethanoylpiperazin-1-yl)-3-[2-fluoranyl-4-(2-methoxyphenyl)sulfanyl-phenyl]prop-2-en-1-one

Systemtic Name: (E)-1-(4-ethanoylpiperazin-1-yl)-3-[2-fluoranyl-4-(2-methoxyphenyl)sulfanyl-phenyl]prop-2-en-1-one Openeye Name: (E)-1-(4-acetylpiperazin-1-yl)-3-[2-fluoro-4-(2-methoxyphenyl)sulfanyl-phenyl]prop-2-en-1-one CAS Name: (E)-1-(4-acetyl-1-piperazinyl)-3-[2-fluoro-4-[(2-methoxyphenyl)thio]phenyl]-2-propen-1-one IUPAC Name: (E)-1-(4-acetylpiperazin-1-yl)-3-[2-fluoro-4-(2-methoxyphenyl)sulfanylphenyl]prop-2-en-1-one Traditional Name: (E)-1-(4-acetylpiperazino)-3-[2-fluoro-4-[(2-methoxyphenyl)thio]phenyl]prop-2-en-1-one Formula: C22H23FN2O3S MolecularWeight: 414.493023

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)C(=O)C=CC2=C(C=C(C=C2)SC3=CC=CC=C3OC)F

Isomeric SMILES

CC(=O)N1CCN(CC1)C(=O)/C=C/C2=C(C=C(C=C2)SC3=CC=CC=C3OC)F

InChI

InChI=1S/C22H23FN2O3S/c1-16(26)24-11-13-25(14-12-24)22(27)10-8-17-7-9-18(15-19(17)23)29-21-6-4-3-5-20(21)28-2/h3-10,15H,11-14H2,1-2H3/b10-8+