N-(cyanomethyl)-N-phenyl-2-pyrimidin-2-ylsulfanyl-ethanamide

Systemtic Name: N-(cyanomethyl)-N-phenyl-2-pyrimidin-2-ylsulfanyl-ethanamide Openeye Name: N-(cyanomethyl)-N-phenyl-2-pyrimidin-2-ylsulfanyl-acetamide CAS Name: N-(cyanomethyl)-N-phenyl-2-(2-pyrimidinylthio)acetamide IUPAC Name: N-(cyanomethyl)-N-phenyl-2-pyrimidin-2-ylsulfanylacetamide Traditional Name: N-(cyanomethyl)-N-phenyl-2-(2-pyrimidylthio)acetamide Formula: C14H12N4OS MolecularWeight: 284.33628

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N(CC#N)C(=O)CSC2=NC=CC=N2

Isomeric SMILES

C1=CC=C(C=C1)N(CC#N)C(=O)CSC2=NC=CC=N2

InChI

InChI=1S/C14H12N4OS/c15-7-10-18(12-5-2-1-3-6-12)13(19)11-20-14-16-8-4-9-17-14/h1-6,8-9H,10-11H2