ethyl 3-[(4-bromanyl-2-methyl-phenyl)amino]-2-methyl-2-methylsulfanyl-3-oxidanylidene-propanoate

Systemtic Name: ethyl 3-[(4-bromanyl-2-methyl-phenyl)amino]-2-methyl-2-methylsulfanyl-3-oxidanylidene-propanoate Openeye Name: ethyl 3-(4-bromo-2-methyl-anilino)-2-methyl-2-methylsulfanyl-3-oxo-propanoate CAS Name: 3-(4-bromo-2-methylanilino)-2-methyl-2-(methylthio)-3-oxopropanoic acid ethyl ester IUPAC Name: ethyl 3-(4-bromo-2-methylanilino)-2-methyl-2-methylsulfanyl-3-oxopropanoate Traditional Name: 3-(4-bromo-2-methyl-anilino)-3-keto-2-methyl-2-(methylthio)propionic acid ethyl ester Formula: C14H18BrNO3S MolecularWeight: 360.26662

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C)(C(=O)NC1=C(C=C(C=C1)Br)C)SC

Isomeric SMILES

CCOC(=O)C(C)(C(=O)NC1=C(C=C(C=C1)Br)C)SC

InChI

InChI=1S/C14H18BrNO3S/c1-5-19-13(18)14(3,20-4)12(17)16-11-7-6-10(15)8-9(11)2/h6-8H,5H2,1-4H3,(H,16,17)