2-[5-cyano-6-methylsulfanyl-2-(2-oxidanylidene-2-phenylazanyl-ethyl)sulfanyl-pyrimidin-4-yl]sulfanyl-N-phenyl-ethanamide

Systemtic Name: 2-[5-cyano-6-methylsulfanyl-2-(2-oxidanylidene-2-phenylazanyl-ethyl)sulfanyl-pyrimidin-4-yl]sulfanyl-N-phenyl-ethanamide Openeye Name: 2-[2-(2-anilino-2-oxo-ethyl)sulfanyl-5-cyano-6-methylsulfanyl-pyrimidin-4-yl]sulfanyl-N-phenyl-acetamide CAS Name: 2-[[2-[(2-anilino-2-oxoethyl)thio]-5-cyano-6-(methylthio)-4-pyrimidinyl]thio]-N-phenylacetamide IUPAC Name: 2-[2-(2-anilino-2-oxoethyl)sulfanyl-5-cyano-6-methylsulfanylpyrimidin-4-yl]sulfanyl-N-phenylacetamide Traditional Name: 2-[[2-[(2-anilino-2-keto-ethyl)thio]-5-cyano-6-(methylthio)pyrimidin-4-yl]thio]-N-phenyl-acetamide Formula: C22H19N5O2S3 MolecularWeight: 481.61356

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C(=NC(=N1)SCC(=O)NC2=CC=CC=C2)SCC(=O)NC3=CC=CC=C3)C#N

Isomeric SMILES

CSC1=C(C(=NC(=N1)SCC(=O)NC2=CC=CC=C2)SCC(=O)NC3=CC=CC=C3)C#N

InChI

InChI=1S/C22H19N5O2S3/c1-30-20-17(12-23)21(31-13-18(28)24-15-8-4-2-5-9-15)27-22(26-20)32-14-19(29)25-16-10-6-3-7-11-16/h2-11H,13-14H2,1H3,(H,24,28)(H,25,29)