2-[2-(4-bromanyl-2,5-dimethyl-phenyl)sulfanylethanoyl-methyl-amino]-N-(5-methyl-1,2-oxazol-3-yl)ethanamide

Systemtic Name: 2-[2-(4-bromanyl-2,5-dimethyl-phenyl)sulfanylethanoyl-methyl-amino]-N-(5-methyl-1,2-oxazol-3-yl)ethanamide Openeye Name: 2-[[2-(4-bromo-2,5-dimethyl-phenyl)sulfanylacetyl]-methyl-amino]-N-(5-methylisoxazol-3-yl)acetamide CAS Name: 2-[[2-[(4-bromo-2,5-dimethylphenyl)thio]-1-oxoethyl]-methylamino]-N-(5-methyl-3-isoxazolyl)acetamide IUPAC Name: 2-[[2-(4-bromo-2,5-dimethylphenyl)sulfanylacetyl]-methylamino]-N-(5-methyl-1,2-oxazol-3-yl)acetamide Traditional Name: 2-[[2-[(4-bromo-2,5-dimethyl-phenyl)thio]acetyl]-methyl-amino]-N-(5-methylisoxazol-3-yl)acetamide Formula: C17H20BrN3O3S MolecularWeight: 426.328

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1Br)C)SCC(=O)N(C)CC(=O)NC2=NOC(=C2)C

Isomeric SMILES

CC1=CC(=C(C=C1Br)C)SCC(=O)N(C)CC(=O)NC2=NOC(=C2)C

InChI

InChI=1S/C17H20BrN3O3S/c1-10-6-14(11(2)5-13(10)18)25-9-17(23)21(4)8-16(22)19-15-7-12(3)24-20-15/h5-7H,8-9H2,1-4H3,(H,19,20,22)