2-[(5-cyano-4-oxidanylidene-6-thiophen-2-yl-1H-pyrimidin-2-yl)sulfanyl]-N-(methylcarbamoyl)ethanamide

Systemtic Name: 2-[(5-cyano-4-oxidanylidene-6-thiophen-2-yl-1H-pyrimidin-2-yl)sulfanyl]-N-(methylcarbamoyl)ethanamide Openeye Name: 2-[[5-cyano-4-oxo-6-(2-thienyl)-1H-pyrimidin-2-yl]sulfanyl]-N-(methylcarbamoyl)acetamide CAS Name: 2-[(5-cyano-4-oxo-6-thiophen-2-yl-1H-pyrimidin-2-yl)thio]-N-(methylcarbamoyl)acetamide IUPAC Name: 2-[(5-cyano-4-oxo-6-thiophen-2-yl-1H-pyrimidin-2-yl)sulfanyl]-N-(methylcarbamoyl)acetamide Traditional Name: 2-[[5-cyano-4-keto-6-(2-thienyl)-1H-pyrimidin-2-yl]thio]-N-(methylcarbamoyl)acetamide Formula: C13H11N5O3S2 MolecularWeight: 349.38814

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)NC(=O)CSC1=NC(=O)C(=C(N1)C2=CC=CS2)C#N

Isomeric SMILES

CNC(=O)NC(=O)CSC1=NC(=O)C(=C(N1)C2=CC=CS2)C#N

InChI

InChI=1S/C13H11N5O3S2/c1-15-12(21)16-9(19)6-23-13-17-10(8-3-2-4-22-8)7(5-14)11(20)18-13/h2-4H,6H2,1H3,(H,17,18,20)(H2,15,16,19,21)