N-[1-(3-bromanyl-4-methoxy-phenyl)ethyl]-2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-[1-(3-bromanyl-4-methoxy-phenyl)ethyl]-2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-ethanamide Openeye Name: N-[1-(3-bromo-4-methoxy-phenyl)ethyl]-2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-acetamide CAS Name: N-[1-(3-bromo-4-methoxyphenyl)ethyl]-2-[(4,6-dimethyl-2-pyrimidinyl)thio]acetamide IUPAC Name: N-[1-(3-bromo-4-methoxyphenyl)ethyl]-2-(4,6-dimethylpyrimidin-2-yl)sulfanylacetamide Traditional Name: N-[1-(3-bromo-4-methoxy-phenyl)ethyl]-2-[(4,6-dimethylpyrimidin-2-yl)thio]acetamide Formula: C17H20BrN3O2S MolecularWeight: 410.3286

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SCC(=O)NC(C)C2=CC(=C(C=C2)OC)Br)C

Isomeric SMILES

CC1=CC(=NC(=N1)SCC(=O)NC(C)C2=CC(=C(C=C2)OC)Br)C

InChI

InChI=1S/C17H20BrN3O2S/c1-10-7-11(2)20-17(19-10)24-9-16(22)21-12(3)13-5-6-15(23-4)14(18)8-13/h5-8,12H,9H2,1-4H3,(H,21,22)