methyl 2-[(4-bromanyl-3-methyl-phenyl)carbonylamino]-4-methylsulfanyl-butanoate

Systemtic Name: methyl 2-[(4-bromanyl-3-methyl-phenyl)carbonylamino]-4-methylsulfanyl-butanoate Openeye Name: methyl 2-[(4-bromo-3-methyl-benzoyl)amino]-4-methylsulfanyl-butanoate CAS Name: 2-[[(4-bromo-3-methylphenyl)-oxomethyl]amino]-4-(methylthio)butanoic acid methyl ester IUPAC Name: methyl 2-[(4-bromo-3-methylbenzoyl)amino]-4-methylsulfanylbutanoate Traditional Name: 2-[(4-bromo-3-methyl-benzoyl)amino]-4-(methylthio)butyric acid methyl ester Formula: C14H18BrNO3S MolecularWeight: 360.26662

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)NC(CCSC)C(=O)OC)Br

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)NC(CCSC)C(=O)OC)Br

InChI

InChI=1S/C14H18BrNO3S/c1-9-8-10(4-5-11(9)15)13(17)16-12(6-7-20-3)14(18)19-2/h4-5,8,12H,6-7H2,1-3H3,(H,16,17)