methyl 6-methylsulfanyl-5-(4-propan-2-yloxyphenyl)carbonyl-2,3-dihydro-1H-pyrrolizine-1-carboxylate

Systemtic Name: methyl 6-methylsulfanyl-5-(4-propan-2-yloxyphenyl)carbonyl-2,3-dihydro-1H-pyrrolizine-1-carboxylate Openeye Name: methyl 5-(4-isopropoxybenzoyl)-6-methylsulfanyl-2,3-dihydro-1H-pyrrolizine-1-carboxylate CAS Name: 6-(methylthio)-5-[oxo-(4-propan-2-yloxyphenyl)methyl]-2,3-dihydro-1H-pyrrolizine-1-carboxylic acid methyl ester IUPAC Name: methyl 6-methylsulfanyl-5-(4-propan-2-yloxybenzoyl)-2,3-dihydro-1H-pyrrolizine-1-carboxylate Traditional Name: 5-(4-isopropoxybenzoyl)-6-(methylthio)-2,3-dihydro-1H-pyrrolizine-1-carboxylic acid methyl ester Formula: C20H23NO4S MolecularWeight: 373.46592

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=C(C=C1)C(=O)C2=C(C=C3N2CCC3C(=O)OC)SC

Isomeric SMILES

CC(C)OC1=CC=C(C=C1)C(=O)C2=C(C=C3N2CCC3C(=O)OC)SC

InChI

InChI=1S/C20H23NO4S/c1-12(2)25-14-7-5-13(6-8-14)19(22)18-17(26-4)11-16-15(20(23)24-3)9-10-21(16)18/h5-8,11-12,15H,9-10H2,1-4H3