ethyl 4-[(3S)-2,5-bis(oxidanylidene)-3-thiomorpholin-4-yl-pyrrolidin-1-yl]benzoate

Systemtic Name: ethyl 4-[(3S)-2,5-bis(oxidanylidene)-3-thiomorpholin-4-yl-pyrrolidin-1-yl]benzoate Openeye Name: ethyl 4-[(3S)-2,5-dioxo-3-thiomorpholino-pyrrolidin-1-yl]benzoate CAS Name: 4-[(3S)-2,5-dioxo-3-thiomorpholin-4-yl-1-pyrrolidinyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[(3S)-2,5-dioxo-3-thiomorpholin-4-ylpyrrolidin-1-yl]benzoate Traditional Name: 4-[(3S)-2,5-diketo-3-thiomorpholino-pyrrolidino]benzoic acid ethyl ester Formula: C17H20N2O4S MolecularWeight: 348.4167

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)N2C(=O)CC(C2=O)N3CCSCC3

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)N2C(=O)C[C@@H](C2=O)N3CCSCC3

InChI

InChI=1S/C17H20N2O4S/c1-2-23-17(22)12-3-5-13(6-4-12)19-15(20)11-14(16(19)21)18-7-9-24-10-8-18/h3-6,14H,2,7-11H2,1H3/t14-/m0/s1