ethyl 4-[[(2S)-2-azanyl-4-methylsulfanyl-butanoyl]amino]benzoate

Systemtic Name: ethyl 4-[[(2S)-2-azanyl-4-methylsulfanyl-butanoyl]amino]benzoate Openeye Name: ethyl 4-[[(2S)-2-amino-4-methylsulfanyl-butanoyl]amino]benzoate CAS Name: 4-[[(2S)-2-amino-4-(methylthio)-1-oxobutyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[(2S)-2-amino-4-methylsulfanylbutanoyl]amino]benzoate Traditional Name: 4-[[(2S)-2-amino-4-(methylthio)butanoyl]amino]benzoic acid ethyl ester Formula: C14H20N2O3S MolecularWeight: 296.3852

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)C(CCSC)N

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)[C@H](CCSC)N

InChI

InChI=1S/C14H20N2O3S/c1-3-19-14(18)10-4-6-11(7-5-10)16-13(17)12(15)8-9-20-2/h4-7,12H,3,8-9,15H2,1-2H3,(H,16,17)/t12-/m0/s1