methyl 2-[(3-ethanoylphenyl)carbamoylamino]-4-methylsulfanyl-butanoate

Systemtic Name: methyl 2-[(3-ethanoylphenyl)carbamoylamino]-4-methylsulfanyl-butanoate Openeye Name: methyl 2-[(3-acetylphenyl)carbamoylamino]-4-methylsulfanyl-butanoate CAS Name: 2-[[(3-acetylanilino)-oxomethyl]amino]-4-(methylthio)butanoic acid methyl ester IUPAC Name: methyl 2-[(3-acetylphenyl)carbamoylamino]-4-methylsulfanylbutanoate Traditional Name: 2-[(3-acetylphenyl)carbamoylamino]-4-(methylthio)butyric acid methyl ester Formula: C15H20N2O4S MolecularWeight: 324.3953

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H20N2O4S/c1-10(18)11-5-4-6-12(9-11)16-15(20)17-13(7-8-22-3)14(19)21-2/h4-6,9,13H,7-8H2,1-3H3,(H2,16,17,20)