N-[5-(5-iodanyl-4-methoxy-2-propan-2-yl-phenoxy)-4-(2-methylpropylamino)pyrimidin-2-yl]-2-methyl-propanamide

Systemtic Name: N-[5-(5-iodanyl-4-methoxy-2-propan-2-yl-phenoxy)-4-(2-methylpropylamino)pyrimidin-2-yl]-2-methyl-propanamide Openeye Name: N-[5-(5-iodo-2-isopropyl-4-methoxy-phenoxy)-4-(isobutylamino)pyrimidin-2-yl]-2-methyl-propanamide CAS Name: N-[5-(5-iodo-4-methoxy-2-propan-2-ylphenoxy)-4-(2-methylpropylamino)-2-pyrimidinyl]-2-methylpropanamide IUPAC Name: N-[5-(5-iodo-4-methoxy-2-propan-2-ylphenoxy)-4-(2-methylpropylamino)pyrimidin-2-yl]-2-methylpropanamide Traditional Name: N-[5-(5-iodo-2-isopropyl-4-methoxy-phenoxy)-4-(isobutylamino)pyrimidin-2-yl]-2-methyl-propionamide Formula: C22H31IN4O3 MolecularWeight: 526.41101

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC1=NC(=NC=C1OC2=CC(=C(C=C2C(C)C)OC)I)NC(=O)C(C)C

Isomeric SMILES

CC(C)CNC1=NC(=NC=C1OC2=CC(=C(C=C2C(C)C)OC)I)NC(=O)C(C)C

InChI

InChI=1S/C22H31IN4O3/c1-12(2)10-24-20-19(11-25-22(26-20)27-21(28)14(5)6)30-17-9-16(23)18(29-7)8-15(17)13(3)4/h8-9,11-14H,10H2,1-7H3,(H2,24,25,26,27,28)