2-[[4-azanyl-5-(5-ethynyl-4-methoxy-2-propan-2-yl-phenoxy)pyrimidin-2-yl]amino]propane-1,3-diol

Systemtic Name: 2-[[4-azanyl-5-(5-ethynyl-4-methoxy-2-propan-2-yl-phenoxy)pyrimidin-2-yl]amino]propane-1,3-diol Openeye Name: 2-[[4-amino-5-(5-ethynyl-2-isopropyl-4-methoxy-phenoxy)pyrimidin-2-yl]amino]propane-1,3-diol CAS Name: 2-[[4-amino-5-(5-ethynyl-4-methoxy-2-propan-2-ylphenoxy)-2-pyrimidinyl]amino]propane-1,3-diol IUPAC Name: 2-[[4-amino-5-(5-ethynyl-4-methoxy-2-propan-2-ylphenoxy)pyrimidin-2-yl]amino]propane-1,3-diol Traditional Name: 2-[[4-amino-5-(5-ethynyl-2-isopropyl-4-methoxy-phenoxy)pyrimidin-2-yl]amino]propane-1,3-diol Formula: C19H24N4O4 MolecularWeight: 372.41826

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C=C(C(=C1)OC)C#C)OC2=CN=C(N=C2N)NC(CO)CO

Isomeric SMILES

CC(C)C1=C(C=C(C(=C1)OC)C#C)OC2=CN=C(N=C2N)NC(CO)CO

InChI

InChI=1S/C19H24N4O4/c1-5-12-6-16(14(11(2)3)7-15(12)26-4)27-17-8-21-19(23-18(17)20)22-13(9-24)10-25/h1,6-8,11,13,24-25H,9-10H2,2-4H3,(H3,20,21,22,23)