ethyl 4-[1-(2,3-dimethylphenyl)-5-oxidanylidene-pyrrolidin-3-yl]carbonylthiomorpholine-3-carboxylate

Systemtic Name: ethyl 4-[1-(2,3-dimethylphenyl)-5-oxidanylidene-pyrrolidin-3-yl]carbonylthiomorpholine-3-carboxylate Openeye Name: ethyl 4-[1-(2,3-dimethylphenyl)-5-oxo-pyrrolidine-3-carbonyl]thiomorpholine-3-carboxylate CAS Name: 4-[[1-(2,3-dimethylphenyl)-5-oxo-3-pyrrolidinyl]-oxomethyl]-3-thiomorpholinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[1-(2,3-dimethylphenyl)-5-oxopyrrolidine-3-carbonyl]thiomorpholine-3-carboxylate Traditional Name: 4-[1-(2,3-dimethylphenyl)-5-keto-pyrrolidine-3-carbonyl]thiomorpholine-3-carboxylic acid ethyl ester Formula: C20H26N2O4S MolecularWeight: 390.49644

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CSCCN1C(=O)C2CC(=O)N(C2)C3=CC=CC(=C3C)C

Isomeric SMILES

CCOC(=O)C1CSCCN1C(=O)C2CC(=O)N(C2)C3=CC=CC(=C3C)C

InChI

InChI=1S/C20H26N2O4S/c1-4-26-20(25)17-12-27-9-8-21(17)19(24)15-10-18(23)22(11-15)16-7-5-6-13(2)14(16)3/h5-7,15,17H,4,8-12H2,1-3H3