1-(dimethylamino)-3-[4-[[5-(imidazol-1-ylmethyl)-4-phenylazanyl-pyrimidin-2-yl]amino]phenoxy]propan-2-ol

Systemtic Name: 1-(dimethylamino)-3-[4-[[5-(imidazol-1-ylmethyl)-4-phenylazanyl-pyrimidin-2-yl]amino]phenoxy]propan-2-ol Openeye Name: 1-[4-[[4-anilino-5-(imidazol-1-ylmethyl)pyrimidin-2-yl]amino]phenoxy]-3-(dimethylamino)propan-2-ol CAS Name: 1-[4-[[4-anilino-5-(1-imidazolylmethyl)-2-pyrimidinyl]amino]phenoxy]-3-(dimethylamino)-2-propanol IUPAC Name: 1-[4-[[4-anilino-5-(imidazol-1-ylmethyl)pyrimidin-2-yl]amino]phenoxy]-3-(dimethylamino)propan-2-ol Traditional Name: 1-[4-[[4-anilino-5-(imidazol-1-ylmethyl)pyrimidin-2-yl]amino]phenoxy]-3-(dimethylamino)propan-2-ol Formula: C25H29N7O2 MolecularWeight: 459.54346

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC(COC1=CC=C(C=C1)NC2=NC=C(C(=N2)NC3=CC=CC=C3)CN4C=CN=C4)O

Isomeric SMILES

CN(C)CC(COC1=CC=C(C=C1)NC2=NC=C(C(=N2)NC3=CC=CC=C3)CN4C=CN=C4)O

InChI

InChI=1S/C25H29N7O2/c1-31(2)16-22(33)17-34-23-10-8-21(9-11-23)29-25-27-14-19(15-32-13-12-26-18-32)24(30-25)28-20-6-4-3-5-7-20/h3-14,18,22,33H,15-17H2,1-2H3,(H2,27,28,29,30)