1-[4-[[5-bromanyl-4-(4-methoxyphenoxy)pyrimidin-2-yl]amino]phenoxy]-3-(dimethylamino)propan-2-ol

Systemtic Name: 1-[4-[[5-bromanyl-4-(4-methoxyphenoxy)pyrimidin-2-yl]amino]phenoxy]-3-(dimethylamino)propan-2-ol Openeye Name: 1-[4-[[5-bromo-4-(4-methoxyphenoxy)pyrimidin-2-yl]amino]phenoxy]-3-(dimethylamino)propan-2-ol CAS Name: 1-[4-[[5-bromo-4-(4-methoxyphenoxy)-2-pyrimidinyl]amino]phenoxy]-3-(dimethylamino)-2-propanol IUPAC Name: 1-[4-[[5-bromo-4-(4-methoxyphenoxy)pyrimidin-2-yl]amino]phenoxy]-3-(dimethylamino)propan-2-ol Traditional Name: 1-[4-[[5-bromo-4-(4-methoxyphenoxy)pyrimidin-2-yl]amino]phenoxy]-3-(dimethylamino)propan-2-ol Formula: C22H25BrN4O4 MolecularWeight: 489.3623

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC(COC1=CC=C(C=C1)NC2=NC=C(C(=N2)OC3=CC=C(C=C3)OC)Br)O

Isomeric SMILES

CN(C)CC(COC1=CC=C(C=C1)NC2=NC=C(C(=N2)OC3=CC=C(C=C3)OC)Br)O

InChI

InChI=1S/C22H25BrN4O4/c1-27(2)13-16(28)14-30-18-6-4-15(5-7-18)25-22-24-12-20(23)21(26-22)31-19-10-8-17(29-3)9-11-19/h4-12,16,28H,13-14H2,1-3H3,(H,24,25,26)