1-(5-bromanylpyridin-2-yl)-3-[2-(6-fluoranyl-2,3-dimethoxy-phenyl)ethyl]thiourea

Systemtic Name: 1-(5-bromanylpyridin-2-yl)-3-[2-(6-fluoranyl-2,3-dimethoxy-phenyl)ethyl]thiourea Openeye Name: 1-(5-bromo-2-pyridyl)-3-[2-(6-fluoro-2,3-dimethoxy-phenyl)ethyl]thiourea CAS Name: 1-(5-bromo-2-pyridinyl)-3-[2-(6-fluoro-2,3-dimethoxyphenyl)ethyl]thiourea IUPAC Name: 1-(5-bromopyridin-2-yl)-3-[2-(6-fluoro-2,3-dimethoxyphenyl)ethyl]thiourea Traditional Name: 1-(5-bromo-2-pyridyl)-3-[2-(6-fluoro-2,3-dimethoxy-phenyl)ethyl]thiourea Formula: C16H17BrFN3O2S MolecularWeight: 414.292483

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C=C1)F)CCNC(=S)NC2=NC=C(C=C2)Br)OC

Isomeric SMILES

COC1=C(C(=C(C=C1)F)CCNC(=S)NC2=NC=C(C=C2)Br)OC

InChI

InChI=1S/C16H17BrFN3O2S/c1-22-13-5-4-12(18)11(15(13)23-2)7-8-19-16(24)21-14-6-3-10(17)9-20-14/h3-6,9H,7-8H2,1-2H3,(H2,19,20,21,24)