2-[(6-azanyl-4-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]-N-(5-bromanylpyrimidin-2-yl)ethanamide

Systemtic Name: 2-[(6-azanyl-4-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]-N-(5-bromanylpyrimidin-2-yl)ethanamide Openeye Name: 2-[(6-amino-4-oxo-1H-pyrimidin-2-yl)sulfanyl]-N-(5-bromopyrimidin-2-yl)acetamide CAS Name: 2-[(6-amino-4-oxo-1H-pyrimidin-2-yl)thio]-N-(5-bromo-2-pyrimidinyl)acetamide IUPAC Name: 2-[(6-amino-4-oxo-1H-pyrimidin-2-yl)sulfanyl]-N-(5-bromopyrimidin-2-yl)acetamide Traditional Name: 2-[(6-amino-4-keto-1H-pyrimidin-2-yl)thio]-N-(5-bromopyrimidin-2-yl)acetamide Formula: C10H9BrN6O2S MolecularWeight: 357.18646

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(NC(=NC1=O)SCC(=O)NC2=NC=C(C=N2)Br)N

Isomeric SMILES

C1=C(NC(=NC1=O)SCC(=O)NC2=NC=C(C=N2)Br)N

InChI

InChI=1S/C10H9BrN6O2S/c11-5-2-13-9(14-3-5)16-8(19)4-20-10-15-6(12)1-7(18)17-10/h1-3H,4H2,(H3,12,15,17,18)(H,13,14,16,19)