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

Systemtic Name: 1-[4-[[5-bromanyl-4-(4-methoxyphenoxy)pyrimidin-2-yl]amino]phenoxy]-3-(2-methylpropylamino)propan-2-ol Openeye Name: 1-[4-[[5-bromo-4-(4-methoxyphenoxy)pyrimidin-2-yl]amino]phenoxy]-3-(isobutylamino)propan-2-ol CAS Name: 1-[4-[[5-bromo-4-(4-methoxyphenoxy)-2-pyrimidinyl]amino]phenoxy]-3-(2-methylpropylamino)-2-propanol IUPAC Name: 1-[4-[[5-bromo-4-(4-methoxyphenoxy)pyrimidin-2-yl]amino]phenoxy]-3-(2-methylpropylamino)propan-2-ol Traditional Name: 1-[4-[[5-bromo-4-(4-methoxyphenoxy)pyrimidin-2-yl]amino]phenoxy]-3-(isobutylamino)propan-2-ol Formula: C24H29BrN4O4 MolecularWeight: 517.41546

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H29BrN4O4/c1-16(2)12-26-13-18(30)15-32-20-6-4-17(5-7-20)28-24-27-14-22(25)23(29-24)33-21-10-8-19(31-3)9-11-21/h4-11,14,16,18,26,30H,12-13,15H2,1-3H3,(H,27,28,29)