N-[2-azanyl-5-(5-iodanyl-4-methoxy-2-propan-2-yl-phenoxy)pyrimidin-4-yl]benzamide

Systemtic Name: N-[2-azanyl-5-(5-iodanyl-4-methoxy-2-propan-2-yl-phenoxy)pyrimidin-4-yl]benzamide Openeye Name: N-[2-amino-5-(5-iodo-2-isopropyl-4-methoxy-phenoxy)pyrimidin-4-yl]benzamide CAS Name: N-[2-amino-5-(5-iodo-4-methoxy-2-propan-2-ylphenoxy)-4-pyrimidinyl]benzamide IUPAC Name: N-[2-amino-5-(5-iodo-4-methoxy-2-propan-2-ylphenoxy)pyrimidin-4-yl]benzamide Traditional Name: N-[2-amino-5-(5-iodo-2-isopropyl-4-methoxy-phenoxy)pyrimidin-4-yl]benzamide Formula: C21H21IN4O3 MolecularWeight: 504.32091

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=C(C=C1OC2=CN=C(N=C2NC(=O)C3=CC=CC=C3)N)I)OC

Isomeric SMILES

CC(C)C1=CC(=C(C=C1OC2=CN=C(N=C2NC(=O)C3=CC=CC=C3)N)I)OC

InChI

InChI=1S/C21H21IN4O3/c1-12(2)14-9-17(28-3)15(22)10-16(14)29-18-11-24-21(23)26-19(18)25-20(27)13-7-5-4-6-8-13/h4-12H,1-3H3,(H3,23,24,25,26,27)