2-[[2-(5-bromanyl-2-methoxy-phenyl)-5-methyl-1,3-oxazol-4-yl]methylsulfanyl]-5,6-dimethyl-1H-pyrimidin-4-one

Systemtic Name: 2-[[2-(5-bromanyl-2-methoxy-phenyl)-5-methyl-1,3-oxazol-4-yl]methylsulfanyl]-5,6-dimethyl-1H-pyrimidin-4-one Openeye Name: 2-[[2-(5-bromo-2-methoxy-phenyl)-5-methyl-oxazol-4-yl]methylsulfanyl]-5,6-dimethyl-1H-pyrimidin-4-one CAS Name: 2-[[2-(5-bromo-2-methoxyphenyl)-5-methyl-4-oxazolyl]methylthio]-5,6-dimethyl-1H-pyrimidin-4-one IUPAC Name: 2-[[2-(5-bromo-2-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methylsulfanyl]-5,6-dimethyl-1H-pyrimidin-4-one Traditional Name: 2-[[2-(5-bromo-2-methoxy-phenyl)-5-methyl-oxazol-4-yl]methylthio]-5,6-dimethyl-1H-pyrimidin-4-one Formula: C18H18BrN3O3S MolecularWeight: 436.32282

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=NC1=O)SCC2=C(OC(=N2)C3=C(C=CC(=C3)Br)OC)C)C

Isomeric SMILES

CC1=C(NC(=NC1=O)SCC2=C(OC(=N2)C3=C(C=CC(=C3)Br)OC)C)C

InChI

InChI=1S/C18H18BrN3O3S/c1-9-10(2)20-18(22-16(9)23)26-8-14-11(3)25-17(21-14)13-7-12(19)5-6-15(13)24-4/h5-7H,8H2,1-4H3,(H,20,22,23)