N-(4-iodanyl-2-methyl-phenyl)-2-pyrimidin-2-ylsulfanyl-ethanamide

Systemtic Name: N-(4-iodanyl-2-methyl-phenyl)-2-pyrimidin-2-ylsulfanyl-ethanamide Openeye Name: N-(4-iodo-2-methyl-phenyl)-2-pyrimidin-2-ylsulfanyl-acetamide CAS Name: N-(4-iodo-2-methylphenyl)-2-(2-pyrimidinylthio)acetamide IUPAC Name: N-(4-iodo-2-methylphenyl)-2-pyrimidin-2-ylsulfanylacetamide Traditional Name: N-(4-iodo-2-methyl-phenyl)-2-(2-pyrimidylthio)acetamide Formula: C13H12IN3OS MolecularWeight: 385.22335

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)I)NC(=O)CSC2=NC=CC=N2

Isomeric SMILES

CC1=C(C=CC(=C1)I)NC(=O)CSC2=NC=CC=N2

InChI

InChI=1S/C13H12IN3OS/c1-9-7-10(14)3-4-11(9)17-12(18)8-19-13-15-5-2-6-16-13/h2-7H,8H2,1H3,(H,17,18)