Nombre: 3-{2-[(2-{[3-(bromomethyl)phenyl]amino}-5-chloropyrimidin-4-yl)amino]ethyl}phenol

IUPAC: 3-[2-[[2-[3-(bromomethyl)anilino]-5-chloropyrimidin-4-yl]amino]ethyl]phenol

SMILES: Oc1cccc(CCNc2nc(Nc3cccc(CBr)c3)ncc2Cl)c1

Canonical SMILES: C1=CC(=CC(=C1)O)CCNC2=NC(=NC=C2Cl)NC3=CC=CC(=C3)CBr

Fórmula molecular: C19H18BrClN4O

Masa molecular: 433.70

InChIKey: MUASVGBMDNEZJO-UHFFFAOYSA-N

InChI:

InChI=1S/C19H18BrClN4O/c20-11-14-4-1-5-15(9-14)24-19-23-12-17(21)18(25-19)22-8-7-13-3-2-6-16(26)10-13/h1-6,9-10,12,26H,7-8,11H2,(H2,22,23,24,25)

Sinónimos

SCHEMBL2520946MUASVGBMDNEZJO-UHFFFAOYSA-N3-{2-[(2-{[3-(Bromomethyl)phenyl]amino}-5-chloropyrimidin-4-yl)amino]ethyl}phenol