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

Systemtic Name: 2-[(6-azanyl-4-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]-N-(cyanomethyl)ethanamide Openeye Name: 2-[(6-amino-4-oxo-1H-pyrimidin-2-yl)sulfanyl]-N-(cyanomethyl)acetamide CAS Name: 2-[(6-amino-4-oxo-1H-pyrimidin-2-yl)thio]-N-(cyanomethyl)acetamide IUPAC Name: 2-[(6-amino-4-oxo-1H-pyrimidin-2-yl)sulfanyl]-N-(cyanomethyl)acetamide Traditional Name: 2-[(6-amino-4-keto-1H-pyrimidin-2-yl)thio]-N-(cyanomethyl)acetamide Formula: C8H9N5O2S MolecularWeight: 239.25436

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(NC(=NC1=O)SCC(=O)NCC#N)N

Isomeric SMILES

C1=C(NC(=NC1=O)SCC(=O)NCC#N)N

InChI

InChI=1S/C8H9N5O2S/c9-1-2-11-7(15)4-16-8-12-5(10)3-6(14)13-8/h3H,2,4H2,(H,11,15)(H3,10,12,13,14)