N-(5-bromanylpyrimidin-2-yl)-2-(5-tert-butyl-2-methyl-phenyl)sulfanyl-ethanamide

Systemtic Name: N-(5-bromanylpyrimidin-2-yl)-2-(5-tert-butyl-2-methyl-phenyl)sulfanyl-ethanamide Openeye Name: N-(5-bromopyrimidin-2-yl)-2-(5-tert-butyl-2-methyl-phenyl)sulfanyl-acetamide CAS Name: N-(5-bromo-2-pyrimidinyl)-2-[(5-tert-butyl-2-methylphenyl)thio]acetamide IUPAC Name: N-(5-bromopyrimidin-2-yl)-2-(5-tert-butyl-2-methylphenyl)sulfanylacetamide Traditional Name: N-(5-bromopyrimidin-2-yl)-2-[(5-tert-butyl-2-methyl-phenyl)thio]acetamide Formula: C17H20BrN3OS MolecularWeight: 394.3292

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H20BrN3OS/c1-11-5-6-12(17(2,3)4)7-14(11)23-10-15(22)21-16-19-8-13(18)9-20-16/h5-9H,10H2,1-4H3,(H,19,20,21,22)