3-[(4-bromanyl-2,6-dimethyl-phenyl)amino]-5-chloranyl-1-(1,4-dimethoxybutan-2-yl)pyrazin-2-one

Systemtic Name: 3-[(4-bromanyl-2,6-dimethyl-phenyl)amino]-5-chloranyl-1-(1,4-dimethoxybutan-2-yl)pyrazin-2-one Openeye Name: 3-(4-bromo-2,6-dimethyl-anilino)-5-chloro-1-[3-methoxy-1-(methoxymethyl)propyl]pyrazin-2-one CAS Name: 3-(4-bromo-2,6-dimethylanilino)-5-chloro-1-(1,4-dimethoxybutan-2-yl)-2-pyrazinone IUPAC Name: 3-(4-bromo-2,6-dimethylanilino)-5-chloro-1-(1,4-dimethoxybutan-2-yl)pyrazin-2-one Traditional Name: 3-(4-bromo-2,6-dimethyl-anilino)-5-chloro-1-[3-methoxy-1-(methoxymethyl)propyl]pyrazin-2-one Formula: C18H23BrClN3O3 MolecularWeight: 444.75052

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1NC2=NC(=CN(C2=O)C(CCOC)COC)Cl)C)Br

Isomeric SMILES

CC1=CC(=CC(=C1NC2=NC(=CN(C2=O)C(CCOC)COC)Cl)C)Br

InChI

InChI=1S/C18H23BrClN3O3/c1-11-7-13(19)8-12(2)16(11)22-17-18(24)23(9-15(20)21-17)14(10-26-4)5-6-25-3/h7-9,14H,5-6,10H2,1-4H3,(H,21,22)