1-[[4-azanyl-5-(5-iodanyl-4-methoxy-2-propan-2-yl-phenoxy)pyrimidin-2-yl]amino]propan-2-ol

Systemtic Name: 1-[[4-azanyl-5-(5-iodanyl-4-methoxy-2-propan-2-yl-phenoxy)pyrimidin-2-yl]amino]propan-2-ol Openeye Name: 1-[[4-amino-5-(5-iodo-2-isopropyl-4-methoxy-phenoxy)pyrimidin-2-yl]amino]propan-2-ol CAS Name: 1-[[4-amino-5-(5-iodo-4-methoxy-2-propan-2-ylphenoxy)-2-pyrimidinyl]amino]-2-propanol IUPAC Name: 1-[[4-amino-5-(5-iodo-4-methoxy-2-propan-2-ylphenoxy)pyrimidin-2-yl]amino]propan-2-ol Traditional Name: 1-[[4-amino-5-(5-iodo-2-isopropyl-4-methoxy-phenoxy)pyrimidin-2-yl]amino]propan-2-ol Formula: C17H23IN4O3 MolecularWeight: 458.29399

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=C(C=C1OC2=CN=C(N=C2N)NCC(C)O)I)OC

Isomeric SMILES

CC(C)C1=CC(=C(C=C1OC2=CN=C(N=C2N)NCC(C)O)I)OC

InChI

InChI=1S/C17H23IN4O3/c1-9(2)11-5-14(24-4)12(18)6-13(11)25-15-8-21-17(22-16(15)19)20-7-10(3)23/h5-6,8-10,23H,7H2,1-4H3,(H3,19,20,21,22)