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

Systemtic Name: ethyl 4-[[(2S)-2-benzamido-4-methylsulfanyl-butanoyl]amino]benzoate Openeye Name: ethyl 4-[[(2S)-2-benzamido-4-methylsulfanyl-butanoyl]amino]benzoate CAS Name: 4-[[(2S)-2-benzamido-4-(methylthio)-1-oxobutyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[(2S)-2-benzamido-4-methylsulfanylbutanoyl]amino]benzoate Traditional Name: 4-[[(2S)-2-benzamido-4-(methylthio)butanoyl]amino]benzoic acid ethyl ester Formula: C21H24N2O4S MolecularWeight: 400.49126

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)C(CCSC)NC(=O)C2=CC=CC=C2

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)[C@H](CCSC)NC(=O)C2=CC=CC=C2

InChI

InChI=1S/C21H24N2O4S/c1-3-27-21(26)16-9-11-17(12-10-16)22-20(25)18(13-14-28-2)23-19(24)15-7-5-4-6-8-15/h4-12,18H,3,13-14H2,1-2H3,(H,22,25)(H,23,24)/t18-/m0/s1