N-[5-(4-bromophenyl)-1,3,4-thiadiazol-2-yl]-1-[3-(trifluoromethyl)phenyl]sulfonyl-pyrrolidine-2-carboxamide

Systemtic Name: N-[5-(4-bromophenyl)-1,3,4-thiadiazol-2-yl]-1-[3-(trifluoromethyl)phenyl]sulfonyl-pyrrolidine-2-carboxamide Openeye Name: N-[5-(4-bromophenyl)-1,3,4-thiadiazol-2-yl]-1-[3-(trifluoromethyl)phenyl]sulfonyl-pyrrolidine-2-carboxamide CAS Name: N-[5-(4-bromophenyl)-1,3,4-thiadiazol-2-yl]-1-[3-(trifluoromethyl)phenyl]sulfonyl-2-pyrrolidinecarboxamide IUPAC Name: N-[5-(4-bromophenyl)-1,3,4-thiadiazol-2-yl]-1-[3-(trifluoromethyl)phenyl]sulfonylpyrrolidine-2-carboxamide Traditional Name: N-[5-(4-bromophenyl)-1,3,4-thiadiazol-2-yl]-1-[3-(trifluoromethyl)phenyl]sulfonyl-pyrrolidine-2-carboxamide Formula: C20H16BrF3N4O3S2 MolecularWeight: 561.39525

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)S(=O)(=O)C2=CC=CC(=C2)C(F)(F)F)C(=O)NC3=NN=C(S3)C4=CC=C(C=C4)Br

Isomeric SMILES

C1CC(N(C1)S(=O)(=O)C2=CC=CC(=C2)C(F)(F)F)C(=O)NC3=NN=C(S3)C4=CC=C(C=C4)Br

InChI

InChI=1S/C20H16BrF3N4O3S2/c21-14-8-6-12(7-9-14)18-26-27-19(32-18)25-17(29)16-5-2-10-28(16)33(30,31)15-4-1-3-13(11-15)20(22,23)24/h1,3-4,6-9,11,16H,2,5,10H2,(H,25,27,29)