methyl (2R)-4-[(3R)-3-acetamido-3-phenyl-propanoyl]thiomorpholine-2-carboxylate

Systemtic Name: methyl (2R)-4-[(3R)-3-acetamido-3-phenyl-propanoyl]thiomorpholine-2-carboxylate Openeye Name: methyl (2R)-4-[(3R)-3-acetamido-3-phenyl-propanoyl]thiomorpholine-2-carboxylate CAS Name: (2R)-4-[(3R)-3-acetamido-1-oxo-3-phenylpropyl]-2-thiomorpholinecarboxylic acid methyl ester IUPAC Name: methyl (2R)-4-[(3R)-3-acetamido-3-phenylpropanoyl]thiomorpholine-2-carboxylate Traditional Name: (2R)-4-[(3R)-3-acetamido-3-phenyl-propanoyl]thiomorpholine-2-carboxylic acid methyl ester Formula: C17H22N2O4S MolecularWeight: 350.43258

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CC(=O)N1CCSC(C1)C(=O)OC)C2=CC=CC=C2

Isomeric SMILES

CC(=O)N[C@H](CC(=O)N1CCS[C@H](C1)C(=O)OC)C2=CC=CC=C2

InChI

InChI=1S/C17H22N2O4S/c1-12(20)18-14(13-6-4-3-5-7-13)10-16(21)19-8-9-24-15(11-19)17(22)23-2/h3-7,14-15H,8-11H2,1-2H3,(H,18,20)/t14-,15-/m1/s1