N-[[5-(4-bromophenyl)furan-2-yl]methyl]-2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-N-methyl-ethanamide

Systemtic Name: N-[[5-(4-bromophenyl)furan-2-yl]methyl]-2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-N-methyl-ethanamide Openeye Name: N-[[5-(4-bromophenyl)-2-furyl]methyl]-2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-N-methyl-acetamide CAS Name: N-[[5-(4-bromophenyl)-2-furanyl]methyl]-2-[(4,6-dimethyl-2-pyrimidinyl)thio]-N-methylacetamide IUPAC Name: N-[[5-(4-bromophenyl)furan-2-yl]methyl]-2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-N-methylacetamide Traditional Name: N-[[5-(4-bromophenyl)-2-furyl]methyl]-2-[(4,6-dimethylpyrimidin-2-yl)thio]-N-methyl-acetamide Formula: C20H20BrN3O2S MolecularWeight: 446.3607

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SCC(=O)N(C)CC2=CC=C(O2)C3=CC=C(C=C3)Br)C

Isomeric SMILES

CC1=CC(=NC(=N1)SCC(=O)N(C)CC2=CC=C(O2)C3=CC=C(C=C3)Br)C

InChI

InChI=1S/C20H20BrN3O2S/c1-13-10-14(2)23-20(22-13)27-12-19(25)24(3)11-17-8-9-18(26-17)15-4-6-16(21)7-5-15/h4-10H,11-12H2,1-3H3