methyl 2-[(4-ethylphenyl)carbonylamino]-4-methylsulfanyl-butanoate

Systemtic Name: methyl 2-[(4-ethylphenyl)carbonylamino]-4-methylsulfanyl-butanoate Openeye Name: methyl 2-[(4-ethylbenzoyl)amino]-4-methylsulfanyl-butanoate CAS Name: 2-[[(4-ethylphenyl)-oxomethyl]amino]-4-(methylthio)butanoic acid methyl ester IUPAC Name: methyl 2-[(4-ethylbenzoyl)amino]-4-methylsulfanylbutanoate Traditional Name: 2-[(4-ethylbenzoyl)amino]-4-(methylthio)butyric acid methyl ester Formula: C15H21NO3S MolecularWeight: 295.39714

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(=O)NC(CCSC)C(=O)OC

Isomeric SMILES

CCC1=CC=C(C=C1)C(=O)NC(CCSC)C(=O)OC

InChI

InChI=1S/C15H21NO3S/c1-4-11-5-7-12(8-6-11)14(17)16-13(9-10-20-3)15(18)19-2/h5-8,13H,4,9-10H2,1-3H3,(H,16,17)