1-[4-[(5-bromanyl-4-phenylazanyl-pyrimidin-2-yl)amino]phenoxy]-2-methyl-3-(propan-2-ylamino)propan-2-ol

Systemtic Name: 1-[4-[(5-bromanyl-4-phenylazanyl-pyrimidin-2-yl)amino]phenoxy]-2-methyl-3-(propan-2-ylamino)propan-2-ol Openeye Name: 1-[4-[(4-anilino-5-bromo-pyrimidin-2-yl)amino]phenoxy]-3-(isopropylamino)-2-methyl-propan-2-ol CAS Name: 1-[4-[(4-anilino-5-bromo-2-pyrimidinyl)amino]phenoxy]-2-methyl-3-(propan-2-ylamino)-2-propanol IUPAC Name: 1-[4-[(4-anilino-5-bromopyrimidin-2-yl)amino]phenoxy]-2-methyl-3-(propan-2-ylamino)propan-2-ol Traditional Name: 1-[4-[(4-anilino-5-bromo-pyrimidin-2-yl)amino]phenoxy]-3-(isopropylamino)-2-methyl-propan-2-ol Formula: C23H28BrN5O2 MolecularWeight: 486.40472

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NCC(C)(COC1=CC=C(C=C1)NC2=NC=C(C(=N2)NC3=CC=CC=C3)Br)O

Isomeric SMILES

CC(C)NCC(C)(COC1=CC=C(C=C1)NC2=NC=C(C(=N2)NC3=CC=CC=C3)Br)O

InChI

InChI=1S/C23H28BrN5O2/c1-16(2)26-14-23(3,30)15-31-19-11-9-18(10-12-19)28-22-25-13-20(24)21(29-22)27-17-7-5-4-6-8-17/h4-13,16,26,30H,14-15H2,1-3H3,(H2,25,27,28,29)