methyl 2-[(4-azanyl-3,5-dimethyl-phenyl)carbonylamino]-4-methylsulfanyl-butanoate

Systemtic Name: methyl 2-[(4-azanyl-3,5-dimethyl-phenyl)carbonylamino]-4-methylsulfanyl-butanoate Openeye Name: methyl 2-[(4-amino-3,5-dimethyl-benzoyl)amino]-4-methylsulfanyl-butanoate CAS Name: 2-[[(4-amino-3,5-dimethylphenyl)-oxomethyl]amino]-4-(methylthio)butanoic acid methyl ester IUPAC Name: methyl 2-[(4-amino-3,5-dimethylbenzoyl)amino]-4-methylsulfanylbutanoate Traditional Name: 2-[(4-amino-3,5-dimethyl-benzoyl)amino]-4-(methylthio)butyric acid methyl ester Formula: C15H22N2O3S MolecularWeight: 310.41178

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1N)C)C(=O)NC(CCSC)C(=O)OC

Isomeric SMILES

CC1=CC(=CC(=C1N)C)C(=O)NC(CCSC)C(=O)OC

InChI

InChI=1S/C15H22N2O3S/c1-9-7-11(8-10(2)13(9)16)14(18)17-12(5-6-21-4)15(19)20-3/h7-8,12H,5-6,16H2,1-4H3,(H,17,18)