2-[(6-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]-N-[3,4,5-tris(bromanyl)-2-methoxy-phenyl]ethanamide

Systemtic Name: 2-[(6-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]-N-[3,4,5-tris(bromanyl)-2-methoxy-phenyl]ethanamide Openeye Name: 2-[(6-oxo-1H-pyrimidin-2-yl)sulfanyl]-N-(3,4,5-tribromo-2-methoxy-phenyl)acetamide CAS Name: 2-[(6-oxo-1H-pyrimidin-2-yl)thio]-N-(3,4,5-tribromo-2-methoxyphenyl)acetamide IUPAC Name: 2-[(6-oxo-1H-pyrimidin-2-yl)sulfanyl]-N-(3,4,5-tribromo-2-methoxyphenyl)acetamide Traditional Name: 2-[(6-keto-1H-pyrimidin-2-yl)thio]-N-(3,4,5-tribromo-2-methoxy-phenyl)acetamide Formula: C13H10Br3N3O3S MolecularWeight: 528.0138

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C=C1NC(=O)CSC2=NC=CC(=O)N2)Br)Br)Br

Isomeric SMILES

COC1=C(C(=C(C=C1NC(=O)CSC2=NC=CC(=O)N2)Br)Br)Br

InChI

InChI=1S/C13H10Br3N3O3S/c1-22-12-7(4-6(14)10(15)11(12)16)18-9(21)5-23-13-17-3-2-8(20)19-13/h2-4H,5H2,1H3,(H,18,21)(H,17,19,20)