5-[(3-iodanyl-4-propan-2-yloxy-phenyl)methyl]pyrimidine-2,4-diamine

Systemtic Name: 5-[(3-iodanyl-4-propan-2-yloxy-phenyl)methyl]pyrimidine-2,4-diamine Openeye Name: 5-[(3-iodo-4-isopropoxy-phenyl)methyl]pyrimidine-2,4-diamine CAS Name: 5-[(3-iodo-4-propan-2-yloxyphenyl)methyl]pyrimidine-2,4-diamine IUPAC Name: 5-[(3-iodo-4-propan-2-yloxyphenyl)methyl]pyrimidine-2,4-diamine Traditional Name: [2-amino-5-(3-iodo-4-isopropoxy-benzyl)pyrimidin-4-yl]amine Formula: C14H17IN4O MolecularWeight: 384.21545

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C(C=C(C=C1)CC2=CN=C(N=C2N)N)I

Isomeric SMILES

CC(C)OC1=C(C=C(C=C1)CC2=CN=C(N=C2N)N)I

InChI

InChI=1S/C14H17IN4O/c1-8(2)20-12-4-3-9(6-11(12)15)5-10-7-18-14(17)19-13(10)16/h3-4,6-8H,5H2,1-2H3,(H4,16,17,18,19)