(E)-3-(3-chloranyl-4-fluoranyl-phenyl)-1-(4-thiophen-2-ylsulfonylpiperazin-1-yl)prop-2-en-1-one

Systemtic Name: (E)-3-(3-chloranyl-4-fluoranyl-phenyl)-1-(4-thiophen-2-ylsulfonylpiperazin-1-yl)prop-2-en-1-one Openeye Name: (E)-3-(3-chloro-4-fluoro-phenyl)-1-[4-(2-thienylsulfonyl)piperazin-1-yl]prop-2-en-1-one CAS Name: (E)-3-(3-chloro-4-fluorophenyl)-1-(4-thiophen-2-ylsulfonyl-1-piperazinyl)-2-propen-1-one IUPAC Name: (E)-3-(3-chloro-4-fluorophenyl)-1-(4-thiophen-2-ylsulfonylpiperazin-1-yl)prop-2-en-1-one Traditional Name: (E)-3-(3-chloro-4-fluoro-phenyl)-1-[4-(2-thienylsulfonyl)piperazino]prop-2-en-1-one Formula: C17H16ClFN2O3S2 MolecularWeight: 414.901943

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C=CC2=CC(=C(C=C2)F)Cl)S(=O)(=O)C3=CC=CS3

Isomeric SMILES

C1CN(CCN1C(=O)/C=C/C2=CC(=C(C=C2)F)Cl)S(=O)(=O)C3=CC=CS3

InChI

InChI=1S/C17H16ClFN2O3S2/c18-14-12-13(3-5-15(14)19)4-6-16(22)20-7-9-21(10-8-20)26(23,24)17-2-1-11-25-17/h1-6,11-12H,7-10H2/b6-4+