ethyl 3-(4-fluorophenyl)-1-(4-methylsulfanylphenyl)-6,7-dihydro-5H-pyrrolizine-2-carboxylate

Systemtic Name: ethyl 3-(4-fluorophenyl)-1-(4-methylsulfanylphenyl)-6,7-dihydro-5H-pyrrolizine-2-carboxylate Openeye Name: ethyl 3-(4-fluorophenyl)-1-(4-methylsulfanylphenyl)-6,7-dihydro-5H-pyrrolizine-2-carboxylate CAS Name: 3-(4-fluorophenyl)-1-[4-(methylthio)phenyl]-6,7-dihydro-5H-pyrrolizine-2-carboxylic acid ethyl ester IUPAC Name: ethyl 3-(4-fluorophenyl)-1-(4-methylsulfanylphenyl)-6,7-dihydro-5H-pyrrolizine-2-carboxylate Traditional Name: 3-(4-fluorophenyl)-1-[4-(methylthio)phenyl]-6,7-dihydro-5H-pyrrolizine-2-carboxylic acid ethyl ester Formula: C23H22FNO2S MolecularWeight: 395.489683

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N2CCCC2=C1C3=CC=C(C=C3)SC)C4=CC=C(C=C4)F

Isomeric SMILES

CCOC(=O)C1=C(N2CCCC2=C1C3=CC=C(C=C3)SC)C4=CC=C(C=C4)F

InChI

InChI=1S/C23H22FNO2S/c1-3-27-23(26)21-20(15-8-12-18(28-2)13-9-15)19-5-4-14-25(19)22(21)16-6-10-17(24)11-7-16/h6-13H,3-5,14H2,1-2H3