methyl 2-[[(2S)-4-methylsulfanyl-2-[[(2R)-2-phenylpropanoyl]amino]butanoyl]amino]ethanoate

Systemtic Name: methyl 2-[[(2S)-4-methylsulfanyl-2-[[(2R)-2-phenylpropanoyl]amino]butanoyl]amino]ethanoate Openeye Name: methyl 2-[[(2S)-4-methylsulfanyl-2-[[(2R)-2-phenylpropanoyl]amino]butanoyl]amino]acetate CAS Name: 2-[[(2S)-4-(methylthio)-1-oxo-2-[[(2R)-1-oxo-2-phenylpropyl]amino]butyl]amino]acetic acid methyl ester IUPAC Name: methyl 2-[[(2S)-4-methylsulfanyl-2-[[(2R)-2-phenylpropanoyl]amino]butanoyl]amino]acetate Traditional Name: 2-[[(2S)-4-(methylthio)-2-[[(2R)-2-phenylpropanoyl]amino]butanoyl]amino]acetic acid methyl ester Formula: C17H24N2O4S MolecularWeight: 352.44846

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C[C@H](C1=CC=CC=C1)C(=O)N[C@@H](CCSC)C(=O)NCC(=O)OC

InChI

InChI=1S/C17H24N2O4S/c1-12(13-7-5-4-6-8-13)16(21)19-14(9-10-24-3)17(22)18-11-15(20)23-2/h4-8,12,14H,9-11H2,1-3H3,(H,18,22)(H,19,21)/t12-,14+/m1/s1