2-[(3-bromanyl-2-methyl-phenyl)amino]-6-(methoxymethyl)-3-methyl-pyrimidin-4-one

Systemtic Name: 2-[(3-bromanyl-2-methyl-phenyl)amino]-6-(methoxymethyl)-3-methyl-pyrimidin-4-one Openeye Name: 2-(3-bromo-2-methyl-anilino)-6-(methoxymethyl)-3-methyl-pyrimidin-4-one CAS Name: 2-(3-bromo-2-methylanilino)-6-(methoxymethyl)-3-methyl-4-pyrimidinone IUPAC Name: 2-(3-bromo-2-methylanilino)-6-(methoxymethyl)-3-methylpyrimidin-4-one Traditional Name: 2-(3-bromo-2-methyl-anilino)-6-(methoxymethyl)-3-methyl-pyrimidin-4-one Formula: C14H16BrN3O2 MolecularWeight: 338.19974

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Br)NC2=NC(=CC(=O)N2C)COC

Isomeric SMILES

CC1=C(C=CC=C1Br)NC2=NC(=CC(=O)N2C)COC

InChI

InChI=1S/C14H16BrN3O2/c1-9-11(15)5-4-6-12(9)17-14-16-10(8-20-3)7-13(19)18(14)2/h4-7H,8H2,1-3H3,(H,16,17)