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

Systemtic Name: methyl 2-[(4-azanyl-3,5-dimethyl-phenyl)carbonylamino]-3-methylsulfanyl-propanoate Openeye Name: methyl 2-[(4-amino-3,5-dimethyl-benzoyl)amino]-3-methylsulfanyl-propanoate CAS Name: 2-[[(4-amino-3,5-dimethylphenyl)-oxomethyl]amino]-3-(methylthio)propanoic acid methyl ester IUPAC Name: methyl 2-[(4-amino-3,5-dimethylbenzoyl)amino]-3-methylsulfanylpropanoate Traditional Name: 2-[(4-amino-3,5-dimethyl-benzoyl)amino]-3-(methylthio)propionic acid methyl ester Formula: C14H20N2O3S MolecularWeight: 296.3852

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H20N2O3S/c1-8-5-10(6-9(2)12(8)15)13(17)16-11(7-20-4)14(18)19-3/h5-6,11H,7,15H2,1-4H3,(H,16,17)