methyl (2R)-4-[2-[(4-phenoxyphenyl)carbonylamino]ethanoyl]thiomorpholine-2-carboxylate

Systemtic Name: methyl (2R)-4-[2-[(4-phenoxyphenyl)carbonylamino]ethanoyl]thiomorpholine-2-carboxylate Openeye Name: methyl (2R)-4-[2-[(4-phenoxybenzoyl)amino]acetyl]thiomorpholine-2-carboxylate CAS Name: (2R)-4-[1-oxo-2-[[oxo-(4-phenoxyphenyl)methyl]amino]ethyl]-2-thiomorpholinecarboxylic acid methyl ester IUPAC Name: methyl (2R)-4-[2-[(4-phenoxybenzoyl)amino]acetyl]thiomorpholine-2-carboxylate Traditional Name: (2R)-4-[2-[(4-phenoxybenzoyl)amino]acetyl]thiomorpholine-2-carboxylic acid methyl ester Formula: C21H22N2O5S MolecularWeight: 414.47478

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CN(CCS1)C(=O)CNC(=O)C2=CC=C(C=C2)OC3=CC=CC=C3

Isomeric SMILES

COC(=O)[C@H]1CN(CCS1)C(=O)CNC(=O)C2=CC=C(C=C2)OC3=CC=CC=C3

InChI

InChI=1S/C21H22N2O5S/c1-27-21(26)18-14-23(11-12-29-18)19(24)13-22-20(25)15-7-9-17(10-8-15)28-16-5-3-2-4-6-16/h2-10,18H,11-14H2,1H3,(H,22,25)/t18-/m1/s1