dimethyl (2S)-2-[[3-(4-methoxyphenyl)thiomorpholin-4-yl]carbonylamino]pentanedioate

Systemtic Name: dimethyl (2S)-2-[[3-(4-methoxyphenyl)thiomorpholin-4-yl]carbonylamino]pentanedioate Openeye Name: dimethyl (2S)-2-[[3-(4-methoxyphenyl)thiomorpholine-4-carbonyl]amino]pentanedioate CAS Name: (2S)-2-[[[3-(4-methoxyphenyl)-4-thiomorpholinyl]-oxomethyl]amino]pentanedioic acid dimethyl ester IUPAC Name: dimethyl (2S)-2-[[3-(4-methoxyphenyl)thiomorpholine-4-carbonyl]amino]pentanedioate Traditional Name: (2S)-2-[[3-(4-methoxyphenyl)thiomorpholine-4-carbonyl]amino]glutaric acid dimethyl ester Formula: C19H26N2O6S MolecularWeight: 410.48454

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2CSCCN2C(=O)NC(CCC(=O)OC)C(=O)OC

Isomeric SMILES

COC1=CC=C(C=C1)C2CSCCN2C(=O)N[C@@H](CCC(=O)OC)C(=O)OC

InChI

InChI=1S/C19H26N2O6S/c1-25-14-6-4-13(5-7-14)16-12-28-11-10-21(16)19(24)20-15(18(23)27-3)8-9-17(22)26-2/h4-7,15-16H,8-12H2,1-3H3,(H,20,24)/t15-,16?/m0/s1