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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C2CCCN2C(=C1C3=CC=C(C=C3)SC)C4=CC=C(C=C4)F

Isomeric SMILES

CCOC(=O)C1=C2CCCN2C(=C1C3=CC=C(C=C3)SC)C4=CC=C(C=C4)F

InChI

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