N-[4-[1-(2-bromophenyl)ethylsulfanylcarbamoylamino]phenyl]-2-fluoranyl-benzamide

Systemtic Name: N-[4-[1-(2-bromophenyl)ethylsulfanylcarbamoylamino]phenyl]-2-fluoranyl-benzamide Openeye Name: N-[4-[1-(2-bromophenyl)ethylsulfanylcarbamoylamino]phenyl]-2-fluoro-benzamide CAS Name: N-[4-[[[[1-(2-bromophenyl)ethylthio]amino]-oxomethyl]amino]phenyl]-2-fluorobenzamide IUPAC Name: N-[4-[1-(2-bromophenyl)ethylsulfanylcarbamoylamino]phenyl]-2-fluorobenzamide Traditional Name: N-[4-[[1-(2-bromophenyl)ethylthio]carbamoylamino]phenyl]-2-fluoro-benzamide Formula: C22H19BrFN3O2S MolecularWeight: 488.372563

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1Br)SNC(=O)NC2=CC=C(C=C2)NC(=O)C3=CC=CC=C3F

Isomeric SMILES

CC(C1=CC=CC=C1Br)SNC(=O)NC2=CC=C(C=C2)NC(=O)C3=CC=CC=C3F

InChI

InChI=1S/C22H19BrFN3O2S/c1-14(17-6-2-4-8-19(17)23)30-27-22(29)26-16-12-10-15(11-13-16)25-21(28)18-7-3-5-9-20(18)24/h2-14H,1H3,(H,25,28)(H2,26,27,29)