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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)SC1=CC=CC(=C1)C(=O)C2=CC=C3N2CCC3C(=O)OC

Isomeric SMILES

CC(C)SC1=CC=CC(=C1)C(=O)C2=CC=C3N2CCC3C(=O)OC

InChI

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