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

Systemtic Name: 2-[(6-azanyl-4-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]-N-[3,5-bis(bromanyl)-4-methyl-phenyl]ethanamide Openeye Name: 2-[(6-amino-4-oxo-1H-pyrimidin-2-yl)sulfanyl]-N-(3,5-dibromo-4-methyl-phenyl)acetamide CAS Name: 2-[(6-amino-4-oxo-1H-pyrimidin-2-yl)thio]-N-(3,5-dibromo-4-methylphenyl)acetamide IUPAC Name: 2-[(6-amino-4-oxo-1H-pyrimidin-2-yl)sulfanyl]-N-(3,5-dibromo-4-methylphenyl)acetamide Traditional Name: 2-[(6-amino-4-keto-1H-pyrimidin-2-yl)thio]-N-(3,5-dibromo-4-methyl-phenyl)acetamide Formula: C13H12Br2N4O2S MolecularWeight: 448.13298

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1Br)NC(=O)CSC2=NC(=O)C=C(N2)N)Br

Isomeric SMILES

CC1=C(C=C(C=C1Br)NC(=O)CSC2=NC(=O)C=C(N2)N)Br

InChI

InChI=1S/C13H12Br2N4O2S/c1-6-8(14)2-7(3-9(6)15)17-12(21)5-22-13-18-10(16)4-11(20)19-13/h2-4H,5H2,1H3,(H,17,21)(H3,16,18,19,20)