1-piperazin-1-yl-3-[4-[2,4,7-tris(azanyl)pteridin-6-yl]phenoxy]propan-2-ol

Systemtic Name: 1-piperazin-1-yl-3-[4-[2,4,7-tris(azanyl)pteridin-6-yl]phenoxy]propan-2-ol Openeye Name: 1-piperazin-1-yl-3-[4-(2,4,7-triaminopteridin-6-yl)phenoxy]propan-2-ol CAS Name: 1-(1-piperazinyl)-3-[4-(2,4,7-triamino-6-pteridinyl)phenoxy]-2-propanol IUPAC Name: 1-piperazin-1-yl-3-[4-(2,4,7-triaminopteridin-6-yl)phenoxy]propan-2-ol Traditional Name: 1-piperazino-3-[4-(2,4,7-triaminopteridin-6-yl)phenoxy]propan-2-ol Formula: C19H25N9O2 MolecularWeight: 411.4609

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)CC(COC2=CC=C(C=C2)C3=NC4=C(N=C3N)N=C(N=C4N)N)O

Isomeric SMILES

C1CN(CCN1)CC(COC2=CC=C(C=C2)C3=NC4=C(N=C3N)N=C(N=C4N)N)O

InChI

InChI=1S/C19H25N9O2/c20-16-14(24-15-17(21)26-19(22)27-18(15)25-16)11-1-3-13(4-2-11)30-10-12(29)9-28-7-5-23-6-8-28/h1-4,12,23,29H,5-10H2,(H6,20,21,22,25,26,27)