(2-ethoxy-4-pyrrolidin-1-ylcarbothioyl-phenyl) 2-(4-fluorophenyl)ethanoate

Systemtic Name: (2-ethoxy-4-pyrrolidin-1-ylcarbothioyl-phenyl) 2-(4-fluorophenyl)ethanoate Openeye Name: [2-ethoxy-4-(pyrrolidine-1-carbothioyl)phenyl] 2-(4-fluorophenyl)acetate CAS Name: 2-(4-fluorophenyl)acetic acid [2-ethoxy-4-[1-pyrrolidinyl(sulfanylidene)methyl]phenyl] ester IUPAC Name: [2-ethoxy-4-(pyrrolidine-1-carbothioyl)phenyl] 2-(4-fluorophenyl)acetate Traditional Name: 2-(4-fluorophenyl)acetic acid [2-ethoxy-4-(pyrrolidine-1-carbothioyl)phenyl] ester Formula: C21H22FNO3S MolecularWeight: 387.467683

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C(=S)N2CCCC2)OC(=O)CC3=CC=C(C=C3)F

Isomeric SMILES

CCOC1=C(C=CC(=C1)C(=S)N2CCCC2)OC(=O)CC3=CC=C(C=C3)F

InChI

InChI=1S/C21H22FNO3S/c1-2-25-19-14-16(21(27)23-11-3-4-12-23)7-10-18(19)26-20(24)13-15-5-8-17(22)9-6-15/h5-10,14H,2-4,11-13H2,1H3