tert-butyl 5-[4-(trifluoromethyl)phenyl]thieno[3,2-b]pyrrole-4-carboxylate

Systemtic Name: tert-butyl 5-[4-(trifluoromethyl)phenyl]thieno[3,2-b]pyrrole-4-carboxylate Openeye Name: tert-butyl 5-[4-(trifluoromethyl)phenyl]thieno[3,2-b]pyrrole-4-carboxylate CAS Name: 5-[4-(trifluoromethyl)phenyl]-4-thieno[3,2-b]pyrrolecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 5-[4-(trifluoromethyl)phenyl]thieno[3,2-b]pyrrole-4-carboxylate Traditional Name: 5-[4-(trifluoromethyl)phenyl]thieno[3,2-b]pyrrole-4-carboxylic acid tert-butyl ester Formula: C18H16F3NO2S MolecularWeight: 367.38535

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1C2=C(C=C1C3=CC=C(C=C3)C(F)(F)F)SC=C2

Isomeric SMILES

CC(C)(C)OC(=O)N1C2=C(C=C1C3=CC=C(C=C3)C(F)(F)F)SC=C2

InChI

InChI=1S/C18H16F3NO2S/c1-17(2,3)24-16(23)22-13-8-9-25-15(13)10-14(22)11-4-6-12(7-5-11)18(19,20)21/h4-10H,1-3H3