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

Systemtic Name: 1-(5-bromanylpyridin-2-yl)-3-[2-(6-chloranyl-3-ethoxy-2-fluoranyl-phenyl)ethyl]thiourea Openeye Name: 1-(5-bromo-2-pyridyl)-3-[2-(6-chloro-3-ethoxy-2-fluoro-phenyl)ethyl]thiourea CAS Name: 1-(5-bromo-2-pyridinyl)-3-[2-(6-chloro-3-ethoxy-2-fluorophenyl)ethyl]thiourea IUPAC Name: 1-(5-bromopyridin-2-yl)-3-[2-(6-chloro-3-ethoxy-2-fluorophenyl)ethyl]thiourea Traditional Name: 1-(5-bromo-2-pyridyl)-3-[2-(6-chloro-3-ethoxy-2-fluoro-phenyl)ethyl]thiourea Formula: C16H16BrClFN3OS MolecularWeight: 432.738143

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=C(C=C1)Cl)CCNC(=S)NC2=NC=C(C=C2)Br)F

Isomeric SMILES

CCOC1=C(C(=C(C=C1)Cl)CCNC(=S)NC2=NC=C(C=C2)Br)F

InChI

InChI=1S/C16H16BrClFN3OS/c1-2-23-13-5-4-12(18)11(15(13)19)7-8-20-16(24)22-14-6-3-10(17)9-21-14/h3-6,9H,2,7-8H2,1H3,(H2,20,21,22,24)