4-[2,4-bis(azanyl)pyrimidin-5-yl]oxy-2-iodanyl-5-propan-2-yl-phenol

Systemtic Name: 4-[2,4-bis(azanyl)pyrimidin-5-yl]oxy-2-iodanyl-5-propan-2-yl-phenol Openeye Name: 4-(2,4-diaminopyrimidin-5-yl)oxy-2-iodo-5-isopropyl-phenol CAS Name: 4-[(2,4-diamino-5-pyrimidinyl)oxy]-2-iodo-5-propan-2-ylphenol IUPAC Name: 4-(2,4-diaminopyrimidin-5-yl)oxy-2-iodo-5-propan-2-ylphenol Traditional Name: 4-(2,4-diaminopyrimidin-5-yl)oxy-2-iodo-5-isopropyl-phenol Formula: C13H15IN4O2 MolecularWeight: 386.18827

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H15IN4O2/c1-6(2)7-3-9(19)8(14)4-10(7)20-11-5-17-13(16)18-12(11)15/h3-6,19H,1-2H3,(H4,15,16,17,18)