2-[[5-bromanyl-4-(pyridin-2-ylamino)pyrimidin-2-yl]amino]-5-[3-(dimethylamino)propoxy]phenol

Systemtic Name: 2-[[5-bromanyl-4-(pyridin-2-ylamino)pyrimidin-2-yl]amino]-5-[3-(dimethylamino)propoxy]phenol Openeye Name: 2-[[5-bromo-4-(2-pyridylamino)pyrimidin-2-yl]amino]-5-[3-(dimethylamino)propoxy]phenol CAS Name: 2-[[5-bromo-4-(2-pyridinylamino)-2-pyrimidinyl]amino]-5-[3-(dimethylamino)propoxy]phenol IUPAC Name: 2-[[5-bromo-4-(pyridin-2-ylamino)pyrimidin-2-yl]amino]-5-[3-(dimethylamino)propoxy]phenol Traditional Name: 2-[[5-bromo-4-(2-pyridylamino)pyrimidin-2-yl]amino]-5-[3-(dimethylamino)propoxy]phenol Formula: C20H23BrN6O2 MolecularWeight: 459.33962

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCCOC1=CC(=C(C=C1)NC2=NC=C(C(=N2)NC3=CC=CC=N3)Br)O

Isomeric SMILES

CN(C)CCCOC1=CC(=C(C=C1)NC2=NC=C(C(=N2)NC3=CC=CC=N3)Br)O

InChI

InChI=1S/C20H23BrN6O2/c1-27(2)10-5-11-29-14-7-8-16(17(28)12-14)24-20-23-13-15(21)19(26-20)25-18-6-3-4-9-22-18/h3-4,6-9,12-13,28H,5,10-11H2,1-2H3,(H2,22,23,24,25,26)