methyl 5-(2-propan-2-ylsulfanylphenyl)carbonyl-2,3-dihydro-1H-pyrrolizine-1-carboxylate

Systemtic Name: methyl 5-(2-propan-2-ylsulfanylphenyl)carbonyl-2,3-dihydro-1H-pyrrolizine-1-carboxylate Openeye Name: methyl 5-(2-isopropylsulfanylbenzoyl)-2,3-dihydro-1H-pyrrolizine-1-carboxylate CAS Name: 5-[oxo-[2-(propan-2-ylthio)phenyl]methyl]-2,3-dihydro-1H-pyrrolizine-1-carboxylic acid methyl ester IUPAC Name: methyl 5-(2-propan-2-ylsulfanylbenzoyl)-2,3-dihydro-1H-pyrrolizine-1-carboxylate Traditional Name: 5-[2-(isopropylthio)benzoyl]-2,3-dihydro-1H-pyrrolizine-1-carboxylic acid methyl ester Formula: C19H21NO3S MolecularWeight: 343.43994

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)SC1=CC=CC=C1C(=O)C2=CC=C3N2CCC3C(=O)OC

Isomeric SMILES

CC(C)SC1=CC=CC=C1C(=O)C2=CC=C3N2CCC3C(=O)OC

InChI

InChI=1S/C19H21NO3S/c1-12(2)24-17-7-5-4-6-14(17)18(21)16-9-8-15-13(19(22)23-3)10-11-20(15)16/h4-9,12-13H,10-11H2,1-3H3