2-(2-fluorophenyl)sulfanylethyl 4-(2,5-dimethylpyrrol-1-yl)benzoate

Systemtic Name: 2-(2-fluorophenyl)sulfanylethyl 4-(2,5-dimethylpyrrol-1-yl)benzoate Openeye Name: 2-(2-fluorophenyl)sulfanylethyl 4-(2,5-dimethylpyrrol-1-yl)benzoate CAS Name: 4-(2,5-dimethyl-1-pyrrolyl)benzoic acid 2-[(2-fluorophenyl)thio]ethyl ester IUPAC Name: 2-(2-fluorophenyl)sulfanylethyl 4-(2,5-dimethylpyrrol-1-yl)benzoate Traditional Name: 4-(2,5-dimethylpyrrol-1-yl)benzoic acid 2-[(2-fluorophenyl)thio]ethyl ester Formula: C21H20FNO2S MolecularWeight: 369.452403

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(N1C2=CC=C(C=C2)C(=O)OCCSC3=CC=CC=C3F)C

Isomeric SMILES

CC1=CC=C(N1C2=CC=C(C=C2)C(=O)OCCSC3=CC=CC=C3F)C

InChI

InChI=1S/C21H20FNO2S/c1-15-7-8-16(2)23(15)18-11-9-17(10-12-18)21(24)25-13-14-26-20-6-4-3-5-19(20)22/h3-12H,13-14H2,1-2H3