4-[5-[2,4-bis(azanyl)pyrimidin-5-yl]oxy-2-methoxy-4-propan-2-yl-phenyl]but-3-yn-1-ol

Systemtic Name: 4-[5-[2,4-bis(azanyl)pyrimidin-5-yl]oxy-2-methoxy-4-propan-2-yl-phenyl]but-3-yn-1-ol Openeye Name: 4-[5-(2,4-diaminopyrimidin-5-yl)oxy-4-isopropyl-2-methoxy-phenyl]but-3-yn-1-ol CAS Name: 4-[5-[(2,4-diamino-5-pyrimidinyl)oxy]-2-methoxy-4-propan-2-ylphenyl]-3-butyn-1-ol IUPAC Name: 4-[5-(2,4-diaminopyrimidin-5-yl)oxy-2-methoxy-4-propan-2-ylphenyl]but-3-yn-1-ol Traditional Name: 4-[5-(2,4-diaminopyrimidin-5-yl)oxy-4-isopropyl-2-methoxy-phenyl]but-3-yn-1-ol Formula: C18H22N4O3 MolecularWeight: 342.39228

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H22N4O3/c1-11(2)13-9-14(24-3)12(6-4-5-7-23)8-15(13)25-16-10-21-18(20)22-17(16)19/h8-11,23H,5,7H2,1-3H3,(H4,19,20,21,22)