2-[[(3-iodanylphenyl)amino]methyl]-7-methyl-pyrido[1,2-a]pyrimidin-4-one

Systemtic Name: 2-[[(3-iodanylphenyl)amino]methyl]-7-methyl-pyrido[1,2-a]pyrimidin-4-one Openeye Name: 2-[(3-iodoanilino)methyl]-7-methyl-pyrido[1,2-a]pyrimidin-4-one CAS Name: 2-[(3-iodoanilino)methyl]-7-methyl-4-pyrido[1,2-a]pyrimidinone IUPAC Name: 2-[(3-iodoanilino)methyl]-7-methylpyrido[1,2-a]pyrimidin-4-one Traditional Name: 2-[(3-iodoanilino)methyl]-7-methyl-pyrido[1,2-a]pyrimidin-4-one Formula: C16H14IN3O MolecularWeight: 391.20633

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CN2C(=NC(=CC2=O)CNC3=CC(=CC=C3)I)C=C1

Isomeric SMILES

CC1=CN2C(=NC(=CC2=O)CNC3=CC(=CC=C3)I)C=C1

InChI

InChI=1S/C16H14IN3O/c1-11-5-6-15-19-14(8-16(21)20(15)10-11)9-18-13-4-2-3-12(17)7-13/h2-8,10,18H,9H2,1H3