N-[1-(4-bromophenyl)propyl]-2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-[1-(4-bromophenyl)propyl]-2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-ethanamide Openeye Name: N-[1-(4-bromophenyl)propyl]-2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-acetamide CAS Name: N-[1-(4-bromophenyl)propyl]-2-[(4,6-dimethyl-2-pyrimidinyl)thio]acetamide IUPAC Name: N-[1-(4-bromophenyl)propyl]-2-(4,6-dimethylpyrimidin-2-yl)sulfanylacetamide Traditional Name: N-[1-(4-bromophenyl)propyl]-2-[(4,6-dimethylpyrimidin-2-yl)thio]acetamide Formula: C17H20BrN3OS MolecularWeight: 394.3292

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=C(C=C1)Br)NC(=O)CSC2=NC(=CC(=N2)C)C

Isomeric SMILES

CCC(C1=CC=C(C=C1)Br)NC(=O)CSC2=NC(=CC(=N2)C)C

InChI

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