N-[5-[(2-iodanyl-3,4,5-trimethoxy-phenyl)methyl]-2-(2-methylpropanoylamino)pyrimidin-4-yl]-2-methyl-propanamide

Systemtic Name: N-[5-[(2-iodanyl-3,4,5-trimethoxy-phenyl)methyl]-2-(2-methylpropanoylamino)pyrimidin-4-yl]-2-methyl-propanamide Openeye Name: N-[5-[(2-iodo-3,4,5-trimethoxy-phenyl)methyl]-2-(2-methylpropanoylamino)pyrimidin-4-yl]-2-methyl-propanamide CAS Name: N-[5-[(2-iodo-3,4,5-trimethoxyphenyl)methyl]-2-[(2-methyl-1-oxopropyl)amino]-4-pyrimidinyl]-2-methylpropanamide IUPAC Name: N-[5-[(2-iodo-3,4,5-trimethoxyphenyl)methyl]-2-(2-methylpropanoylamino)pyrimidin-4-yl]-2-methylpropanamide Traditional Name: N-[5-(2-iodo-3,4,5-trimethoxy-benzyl)-2-(isobutyrylamino)pyrimidin-4-yl]-2-methyl-propionamide Formula: C22H29IN4O5 MolecularWeight: 556.39393

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NC1=NC(=NC=C1CC2=CC(=C(C(=C2I)OC)OC)OC)NC(=O)C(C)C

Isomeric SMILES

CC(C)C(=O)NC1=NC(=NC=C1CC2=CC(=C(C(=C2I)OC)OC)OC)NC(=O)C(C)C

InChI

InChI=1S/C22H29IN4O5/c1-11(2)20(28)25-19-14(10-24-22(26-19)27-21(29)12(3)4)8-13-9-15(30-5)17(31-6)18(32-7)16(13)23/h9-12H,8H2,1-7H3,(H2,24,25,26,27,28,29)