ethyl (2S,4R)-5-ethylsulfanyl-4-propan-2-yl-3,4-dihydro-2H-pyrrole-2-carboxylate

Systemtic Name: ethyl (2S,4R)-5-ethylsulfanyl-4-propan-2-yl-3,4-dihydro-2H-pyrrole-2-carboxylate Openeye Name: ethyl (2S,4R)-5-ethylsulfanyl-4-isopropyl-3,4-dihydro-2H-pyrrole-2-carboxylate CAS Name: (2S,4R)-5-(ethylthio)-4-propan-2-yl-3,4-dihydro-2H-pyrrole-2-carboxylic acid ethyl ester IUPAC Name: ethyl (2S,4R)-5-ethylsulfanyl-4-propan-2-yl-3,4-dihydro-2H-pyrrole-2-carboxylate Traditional Name: (2S,4R)-5-(ethylthio)-4-isopropyl-1-pyrroline-2-carboxylic acid ethyl ester Formula: C12H21NO2S MolecularWeight: 243.36564

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CC(C(=N1)SCC)C(C)C

Isomeric SMILES

CCOC(=O)[C@@H]1C[C@@H](C(=N1)SCC)C(C)C

InChI

InChI=1S/C12H21NO2S/c1-5-15-12(14)10-7-9(8(3)4)11(13-10)16-6-2/h8-10H,5-7H2,1-4H3/t9-,10+/m1/s1