4-[2-[[5-bromanyl-2-[2-(4-hydroxyphenyl)ethylamino]pyrimidin-4-yl]amino]ethyl]phenol

Systemtic Name: 4-[2-[[5-bromanyl-2-[2-(4-hydroxyphenyl)ethylamino]pyrimidin-4-yl]amino]ethyl]phenol Openeye Name: 4-[2-[[5-bromo-2-[2-(4-hydroxyphenyl)ethylamino]pyrimidin-4-yl]amino]ethyl]phenol CAS Name: 4-[2-[[5-bromo-2-[2-(4-hydroxyphenyl)ethylamino]-4-pyrimidinyl]amino]ethyl]phenol IUPAC Name: 4-[2-[[5-bromo-2-[2-(4-hydroxyphenyl)ethylamino]pyrimidin-4-yl]amino]ethyl]phenol Traditional Name: 4-[2-[[5-bromo-2-[2-(4-hydroxyphenyl)ethylamino]pyrimidin-4-yl]amino]ethyl]phenol Formula: C20H21BrN4O2 MolecularWeight: 429.31034

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CCNC2=NC(=NC=C2Br)NCCC3=CC=C(C=C3)O)O

Isomeric SMILES

C1=CC(=CC=C1CCNC2=NC(=NC=C2Br)NCCC3=CC=C(C=C3)O)O

InChI

InChI=1S/C20H21BrN4O2/c21-18-13-24-20(23-12-10-15-3-7-17(27)8-4-15)25-19(18)22-11-9-14-1-5-16(26)6-2-14/h1-8,13,26-27H,9-12H2,(H2,22,23,24,25)