methyl 2-[(2,4-dimethylphenyl)carbamoylamino]-4-methylsulfanyl-butanoate

Systemtic Name: methyl 2-[(2,4-dimethylphenyl)carbamoylamino]-4-methylsulfanyl-butanoate Openeye Name: methyl 2-[(2,4-dimethylphenyl)carbamoylamino]-4-methylsulfanyl-butanoate CAS Name: 2-[[(2,4-dimethylanilino)-oxomethyl]amino]-4-(methylthio)butanoic acid methyl ester IUPAC Name: methyl 2-[(2,4-dimethylphenyl)carbamoylamino]-4-methylsulfanylbutanoate Traditional Name: 2-[(2,4-dimethylphenyl)carbamoylamino]-4-(methylthio)butyric acid methyl ester Formula: C15H22N2O3S MolecularWeight: 310.41178

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H22N2O3S/c1-10-5-6-12(11(2)9-10)16-15(19)17-13(7-8-21-4)14(18)20-3/h5-6,9,13H,7-8H2,1-4H3,(H2,16,17,19)