1-[4-(5-chloranyl-2-fluoranyl-phenyl)carbonylpiperazin-1-yl]-3-thiophen-3-yl-propan-1-one

Systemtic Name: 1-[4-(5-chloranyl-2-fluoranyl-phenyl)carbonylpiperazin-1-yl]-3-thiophen-3-yl-propan-1-one Openeye Name: 1-[4-(5-chloro-2-fluoro-benzoyl)piperazin-1-yl]-3-(3-thienyl)propan-1-one CAS Name: 1-[4-[(5-chloro-2-fluorophenyl)-oxomethyl]-1-piperazinyl]-3-(3-thiophenyl)-1-propanone IUPAC Name: 1-[4-(5-chloro-2-fluorobenzoyl)piperazin-1-yl]-3-thiophen-3-ylpropan-1-one Traditional Name: 1-[4-(5-chloro-2-fluoro-benzoyl)piperazino]-3-(3-thienyl)propan-1-one Formula: C18H18ClFN2O2S MolecularWeight: 380.864123

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CCC2=CSC=C2)C(=O)C3=C(C=CC(=C3)Cl)F

Isomeric SMILES

C1CN(CCN1C(=O)CCC2=CSC=C2)C(=O)C3=C(C=CC(=C3)Cl)F

InChI

InChI=1S/C18H18ClFN2O2S/c19-14-2-3-16(20)15(11-14)18(24)22-8-6-21(7-9-22)17(23)4-1-13-5-10-25-12-13/h2-3,5,10-12H,1,4,6-9H2