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

Systemtic Name: 3-[(4-bromanyl-2-methoxy-6-methyl-phenyl)amino]-5-chloranyl-1-(1,4-dimethoxybutan-2-yl)pyrazin-2-one Openeye Name: 3-(4-bromo-2-methoxy-6-methyl-anilino)-5-chloro-1-[3-methoxy-1-(methoxymethyl)propyl]pyrazin-2-one CAS Name: 3-(4-bromo-2-methoxy-6-methylanilino)-5-chloro-1-(1,4-dimethoxybutan-2-yl)-2-pyrazinone IUPAC Name: 3-(4-bromo-2-methoxy-6-methylanilino)-5-chloro-1-(1,4-dimethoxybutan-2-yl)pyrazin-2-one Traditional Name: 3-(4-bromo-2-methoxy-6-methyl-anilino)-5-chloro-1-[3-methoxy-1-(methoxymethyl)propyl]pyrazin-2-one Formula: C18H23BrClN3O4 MolecularWeight: 460.74992

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H23BrClN3O4/c1-11-7-12(19)8-14(27-4)16(11)22-17-18(24)23(9-15(20)21-17)13(10-26-3)5-6-25-2/h7-9,13H,5-6,10H2,1-4H3,(H,21,22)