N-[5-cyano-4-(furan-2-yl)-6-methylsulfanyl-pyrimidin-2-yl]-2-(2-iodanylphenyl)ethanamide

Systemtic Name: N-[5-cyano-4-(furan-2-yl)-6-methylsulfanyl-pyrimidin-2-yl]-2-(2-iodanylphenyl)ethanamide Openeye Name: N-[5-cyano-4-(2-furyl)-6-methylsulfanyl-pyrimidin-2-yl]-2-(2-iodophenyl)acetamide CAS Name: N-[5-cyano-4-(2-furanyl)-6-(methylthio)-2-pyrimidinyl]-2-(2-iodophenyl)acetamide IUPAC Name: N-[5-cyano-4-(furan-2-yl)-6-methylsulfanylpyrimidin-2-yl]-2-(2-iodophenyl)acetamide Traditional Name: N-[5-cyano-4-(2-furyl)-6-(methylthio)pyrimidin-2-yl]-2-(2-iodophenyl)acetamide Formula: C18H13IN4O2S MolecularWeight: 476.29089

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC(=NC(=C1C#N)C2=CC=CO2)NC(=O)CC3=CC=CC=C3I

Isomeric SMILES

CSC1=NC(=NC(=C1C#N)C2=CC=CO2)NC(=O)CC3=CC=CC=C3I

InChI

InChI=1S/C18H13IN4O2S/c1-26-17-12(10-20)16(14-7-4-8-25-14)22-18(23-17)21-15(24)9-11-5-2-3-6-13(11)19/h2-8H,9H2,1H3,(H,21,22,23,24)