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

Systemtic Name: N-[5-(4-dimethylaminophenyl)-1,3,4-thiadiazol-2-yl]-1-[3-(trifluoromethyl)phenyl]carbonyl-pyrrolidine-2-carboxamide Openeye Name: N-[5-(4-dimethylaminophenyl)-1,3,4-thiadiazol-2-yl]-1-[3-(trifluoromethyl)benzoyl]pyrrolidine-2-carboxamide CAS Name: N-[5-(4-dimethylaminophenyl)-1,3,4-thiadiazol-2-yl]-1-[oxo-[3-(trifluoromethyl)phenyl]methyl]-2-pyrrolidinecarboxamide IUPAC Name: N-[5-(4-dimethylaminophenyl)-1,3,4-thiadiazol-2-yl]-1-[3-(trifluoromethyl)benzoyl]pyrrolidine-2-carboxamide Traditional Name: N-[5-(4-dimethylaminophenyl)-1,3,4-thiadiazol-2-yl]-1-[3-(trifluoromethyl)benzoyl]pyrrolidine-2-carboxamide Formula: C23H22F3N5O2S MolecularWeight: 489.51329

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)C2=NN=C(S2)NC(=O)C3CCCN3C(=O)C4=CC(=CC=C4)C(F)(F)F

Isomeric SMILES

CN(C)C1=CC=C(C=C1)C2=NN=C(S2)NC(=O)C3CCCN3C(=O)C4=CC(=CC=C4)C(F)(F)F

InChI

InChI=1S/C23H22F3N5O2S/c1-30(2)17-10-8-14(9-11-17)20-28-29-22(34-20)27-19(32)18-7-4-12-31(18)21(33)15-5-3-6-16(13-15)23(24,25)26/h3,5-6,8-11,13,18H,4,7,12H2,1-2H3,(H,27,29,32)