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

Systemtic Name: 2-[(4-oxidanylidene-6-propyl-1H-pyrimidin-2-yl)sulfanyl]-N-[3,4,5-tris(bromanyl)-2-methoxy-phenyl]ethanamide Openeye Name: 2-[(4-oxo-6-propyl-1H-pyrimidin-2-yl)sulfanyl]-N-(3,4,5-tribromo-2-methoxy-phenyl)acetamide CAS Name: 2-[(4-oxo-6-propyl-1H-pyrimidin-2-yl)thio]-N-(3,4,5-tribromo-2-methoxyphenyl)acetamide IUPAC Name: 2-[(4-oxo-6-propyl-1H-pyrimidin-2-yl)sulfanyl]-N-(3,4,5-tribromo-2-methoxyphenyl)acetamide Traditional Name: 2-[(4-keto-6-propyl-1H-pyrimidin-2-yl)thio]-N-(3,4,5-tribromo-2-methoxy-phenyl)acetamide Formula: C16H16Br3N3O3S MolecularWeight: 570.09354

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=O)N=C(N1)SCC(=O)NC2=CC(=C(C(=C2OC)Br)Br)Br

Isomeric SMILES

CCCC1=CC(=O)N=C(N1)SCC(=O)NC2=CC(=C(C(=C2OC)Br)Br)Br

InChI

InChI=1S/C16H16Br3N3O3S/c1-3-4-8-5-11(23)22-16(20-8)26-7-12(24)21-10-6-9(17)13(18)14(19)15(10)25-2/h5-6H,3-4,7H2,1-2H3,(H,21,24)(H,20,22,23)