2-(4-methylphenyl)sulfanyl-N-pyrimidin-2-yl-ethanamide

Systemtic Name: 2-(4-methylphenyl)sulfanyl-N-pyrimidin-2-yl-ethanamide Openeye Name: 2-(p-tolylsulfanyl)-N-pyrimidin-2-yl-acetamide CAS Name: 2-[(4-methylphenyl)thio]-N-(2-pyrimidinyl)acetamide IUPAC Name: 2-(4-methylphenyl)sulfanyl-N-pyrimidin-2-ylacetamide Traditional Name: 2-(p-tolylthio)-N-(2-pyrimidyl)acetamide Formula: C13H13N3OS MolecularWeight: 259.32682

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCC(=O)NC2=NC=CC=N2

Isomeric SMILES

CC1=CC=C(C=C1)SCC(=O)NC2=NC=CC=N2

InChI

InChI=1S/C13H13N3OS/c1-10-3-5-11(6-4-10)18-9-12(17)16-13-14-7-2-8-15-13/h2-8H,9H2,1H3,(H,14,15,16,17)