1-(dimethylamino)-3-[4-[(3-naphthalen-2-yl-[1,2,3]triazolo[4,5-d]pyrimidin-5-yl)amino]phenoxy]propan-2-ol

Systemtic Name: 1-(dimethylamino)-3-[4-[(3-naphthalen-2-yl-[1,2,3]triazolo[4,5-d]pyrimidin-5-yl)amino]phenoxy]propan-2-ol Openeye Name: 1-(dimethylamino)-3-[4-[[3-(2-naphthyl)triazolo[4,5-d]pyrimidin-5-yl]amino]phenoxy]propan-2-ol CAS Name: 1-(dimethylamino)-3-[4-[[3-(2-naphthalenyl)-5-triazolo[4,5-d]pyrimidinyl]amino]phenoxy]-2-propanol IUPAC Name: 1-(dimethylamino)-3-[4-[(3-naphthalen-2-yltriazolo[4,5-d]pyrimidin-5-yl)amino]phenoxy]propan-2-ol Traditional Name: 1-(dimethylamino)-3-[4-[[3-(2-naphthyl)triazolo[4,5-d]pyrimidin-5-yl]amino]phenoxy]propan-2-ol Formula: C25H25N7O2 MolecularWeight: 455.5117

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC(COC1=CC=C(C=C1)NC2=NC=C3C(=N2)N(N=N3)C4=CC5=CC=CC=C5C=C4)O

Isomeric SMILES

CN(C)CC(COC1=CC=C(C=C1)NC2=NC=C3C(=N2)N(N=N3)C4=CC5=CC=CC=C5C=C4)O

InChI

InChI=1S/C25H25N7O2/c1-31(2)15-21(33)16-34-22-11-8-19(9-12-22)27-25-26-14-23-24(28-25)32(30-29-23)20-10-7-17-5-3-4-6-18(17)13-20/h3-14,21,33H,15-16H2,1-2H3,(H,26,27,28)