1-(5-pyrrol-1-yl-1,3,4-thiadiazol-2-yl)-N-[2-(trifluoromethyl)phenyl]piperidine-3-carboxamide

Systemtic Name: 1-(5-pyrrol-1-yl-1,3,4-thiadiazol-2-yl)-N-[2-(trifluoromethyl)phenyl]piperidine-3-carboxamide Openeye Name: 1-(5-pyrrol-1-yl-1,3,4-thiadiazol-2-yl)-N-[2-(trifluoromethyl)phenyl]piperidine-3-carboxamide CAS Name: 1-[5-(1-pyrrolyl)-1,3,4-thiadiazol-2-yl]-N-[2-(trifluoromethyl)phenyl]-3-piperidinecarboxamide IUPAC Name: 1-(5-pyrrol-1-yl-1,3,4-thiadiazol-2-yl)-N-[2-(trifluoromethyl)phenyl]piperidine-3-carboxamide Traditional Name: 1-(5-pyrrol-1-yl-1,3,4-thiadiazol-2-yl)-N-[2-(trifluoromethyl)phenyl]nipecotamide Formula: C19H18F3N5OS MolecularWeight: 421.43933

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C2=NN=C(S2)N3C=CC=C3)C(=O)NC4=CC=CC=C4C(F)(F)F

Isomeric SMILES

C1CC(CN(C1)C2=NN=C(S2)N3C=CC=C3)C(=O)NC4=CC=CC=C4C(F)(F)F

InChI

InChI=1S/C19H18F3N5OS/c20-19(21,22)14-7-1-2-8-15(14)23-16(28)13-6-5-11-27(12-13)18-25-24-17(29-18)26-9-3-4-10-26/h1-4,7-10,13H,5-6,11-12H2,(H,23,28)