1-[[2-(5-bromanyl-2-methoxy-phenyl)-1,3-thiazol-4-yl]methyl]-5-nitro-pyridin-2-one

Systemtic Name: 1-[[2-(5-bromanyl-2-methoxy-phenyl)-1,3-thiazol-4-yl]methyl]-5-nitro-pyridin-2-one Openeye Name: 1-[[2-(5-bromo-2-methoxy-phenyl)thiazol-4-yl]methyl]-5-nitro-pyridin-2-one CAS Name: 1-[[2-(5-bromo-2-methoxyphenyl)-4-thiazolyl]methyl]-5-nitro-2-pyridinone IUPAC Name: 1-[[2-(5-bromo-2-methoxyphenyl)-1,3-thiazol-4-yl]methyl]-5-nitropyridin-2-one Traditional Name: 1-[[2-(5-bromo-2-methoxy-phenyl)thiazol-4-yl]methyl]-5-nitro-2-pyridone Formula: C16H12BrN3O4S MolecularWeight: 422.25318

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Br)C2=NC(=CS2)CN3C=C(C=CC3=O)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)Br)C2=NC(=CS2)CN3C=C(C=CC3=O)[N+](=O)[O-]

InChI

InChI=1S/C16H12BrN3O4S/c1-24-14-4-2-10(17)6-13(14)16-18-11(9-25-16)7-19-8-12(20(22)23)3-5-15(19)21/h2-6,8-9H,7H2,1H3