N-heptan-2-yl-2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-heptan-2-yl-2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanyl-ethanamide Openeye Name: N-(1-methylhexyl)-2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanyl-acetamide CAS Name: N-heptan-2-yl-2-[(4-methyl-6-phenyl-2-pyrimidinyl)thio]acetamide IUPAC Name: N-heptan-2-yl-2-(4-methyl-6-phenylpyrimidin-2-yl)sulfanylacetamide Traditional Name: N-(1-methylhexyl)-2-[(4-methyl-6-phenyl-pyrimidin-2-yl)thio]acetamide Formula: C20H27N3OS MolecularWeight: 357.51288

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)NC(=O)CSC1=NC(=CC(=N1)C)C2=CC=CC=C2

Isomeric SMILES

CCCCCC(C)NC(=O)CSC1=NC(=CC(=N1)C)C2=CC=CC=C2

InChI

InChI=1S/C20H27N3OS/c1-4-5-7-10-15(2)21-19(24)14-25-20-22-16(3)13-18(23-20)17-11-8-6-9-12-17/h6,8-9,11-13,15H,4-5,7,10,14H2,1-3H3,(H,21,24)