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

Systemtic Name: 2-[[2-(5-bromanyl-2-methoxy-phenyl)-1,3-thiazol-4-yl]methylsulfanyl]-1H-pyrimidin-6-one Openeye Name: 2-[[2-(5-bromo-2-methoxy-phenyl)thiazol-4-yl]methylsulfanyl]-1H-pyrimidin-6-one CAS Name: 2-[[2-(5-bromo-2-methoxyphenyl)-4-thiazolyl]methylthio]-1H-pyrimidin-6-one IUPAC Name: 2-[[2-(5-bromo-2-methoxyphenyl)-1,3-thiazol-4-yl]methylsulfanyl]-1H-pyrimidin-6-one Traditional Name: 2-[[2-(5-bromo-2-methoxy-phenyl)thiazol-4-yl]methylthio]-1H-pyrimidin-6-one Formula: C15H12BrN3O2S2 MolecularWeight: 410.30868

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Br)C2=NC(=CS2)CSC3=NC=CC(=O)N3

Isomeric SMILES

COC1=C(C=C(C=C1)Br)C2=NC(=CS2)CSC3=NC=CC(=O)N3

InChI

InChI=1S/C15H12BrN3O2S2/c1-21-12-3-2-9(16)6-11(12)14-18-10(7-22-14)8-23-15-17-5-4-13(20)19-15/h2-7H,8H2,1H3,(H,17,19,20)