5-(5-iodanyl-4-methoxy-2-propan-2-yl-phenoxy)-N4-[1-[(2S)-oxolan-2-yl]ethyl]pyrimidine-2,4-diamine

Systemtic Name: 5-(5-iodanyl-4-methoxy-2-propan-2-yl-phenoxy)-N4-[1-[(2S)-oxolan-2-yl]ethyl]pyrimidine-2,4-diamine Openeye Name: 5-(5-iodo-2-isopropyl-4-methoxy-phenoxy)-N4-[1-[(2S)-tetrahydrofuran-2-yl]ethyl]pyrimidine-2,4-diamine CAS Name: 5-(5-iodo-4-methoxy-2-propan-2-ylphenoxy)-N4-[1-[(2S)-2-oxolanyl]ethyl]pyrimidine-2,4-diamine IUPAC Name: 5-(5-iodo-4-methoxy-2-propan-2-ylphenoxy)-4-N-[1-[(2S)-oxolan-2-yl]ethyl]pyrimidine-2,4-diamine Traditional Name: [2-amino-5-(5-iodo-2-isopropyl-4-methoxy-phenoxy)pyrimidin-4-yl]-[1-[(2S)-tetrahydrofuran-2-yl]ethyl]amine Formula: C20H27IN4O3 MolecularWeight: 498.35785

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=C(C=C1OC2=CN=C(N=C2NC(C)C3CCCO3)N)I)OC

Isomeric SMILES

CC(C)C1=CC(=C(C=C1OC2=CN=C(N=C2NC(C)[C@@H]3CCCO3)N)I)OC

InChI

InChI=1S/C20H27IN4O3/c1-11(2)13-8-17(26-4)14(21)9-16(13)28-18-10-23-20(22)25-19(18)24-12(3)15-6-5-7-27-15/h8-12,15H,5-7H2,1-4H3,(H3,22,23,24,25)/t12?,15-/m0/s1