methyl (3S)-3-[3-(2-oxidanylidene-1,3-thiazolidin-3-yl)propanoylamino]-3-phenyl-propanoate

Systemtic Name: methyl (3S)-3-[3-(2-oxidanylidene-1,3-thiazolidin-3-yl)propanoylamino]-3-phenyl-propanoate Openeye Name: methyl (3S)-3-[3-(2-oxothiazolidin-3-yl)propanoylamino]-3-phenyl-propanoate CAS Name: (3S)-3-[[1-oxo-3-(2-oxo-3-thiazolidinyl)propyl]amino]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl (3S)-3-[3-(2-oxo-1,3-thiazolidin-3-yl)propanoylamino]-3-phenylpropanoate Traditional Name: (3S)-3-[3-(2-ketothiazolidin-3-yl)propanoylamino]-3-phenyl-propionic acid methyl ester Formula: C16H20N2O4S MolecularWeight: 336.406

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC(C1=CC=CC=C1)NC(=O)CCN2CCSC2=O

Isomeric SMILES

COC(=O)C[C@@H](C1=CC=CC=C1)NC(=O)CCN2CCSC2=O

InChI

InChI=1S/C16H20N2O4S/c1-22-15(20)11-13(12-5-3-2-4-6-12)17-14(19)7-8-18-9-10-23-16(18)21/h2-6,13H,7-11H2,1H3,(H,17,19)/t13-/m0/s1