N-(2,6-diethylphenyl)-2-pyrimidin-2-ylsulfanyl-ethanamide

Systemtic Name: N-(2,6-diethylphenyl)-2-pyrimidin-2-ylsulfanyl-ethanamide Openeye Name: N-(2,6-diethylphenyl)-2-pyrimidin-2-ylsulfanyl-acetamide CAS Name: N-(2,6-diethylphenyl)-2-(2-pyrimidinylthio)acetamide IUPAC Name: N-(2,6-diethylphenyl)-2-pyrimidin-2-ylsulfanylacetamide Traditional Name: N-(2,6-diethylphenyl)-2-(2-pyrimidylthio)acetamide Formula: C16H19N3OS MolecularWeight: 301.40656

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=CC=C1)CC)NC(=O)CSC2=NC=CC=N2

Isomeric SMILES

CCC1=C(C(=CC=C1)CC)NC(=O)CSC2=NC=CC=N2

InChI

InChI=1S/C16H19N3OS/c1-3-12-7-5-8-13(4-2)15(12)19-14(20)11-21-16-17-9-6-10-18-16/h5-10H,3-4,11H2,1-2H3,(H,19,20)