N-(4-fluorophenyl)-5-[4-(pyridin-3-ylmethylcarbamoyl)piperidin-1-yl]carbonyl-1,3,4-thiadiazole-2-carboxamide

Systemtic Name: N-(4-fluorophenyl)-5-[4-(pyridin-3-ylmethylcarbamoyl)piperidin-1-yl]carbonyl-1,3,4-thiadiazole-2-carboxamide Openeye Name: N-(4-fluorophenyl)-5-[4-(3-pyridylmethylcarbamoyl)piperidine-1-carbonyl]-1,3,4-thiadiazole-2-carboxamide CAS Name: N-(4-fluorophenyl)-5-[oxo-[4-[oxo-(3-pyridinylmethylamino)methyl]-1-piperidinyl]methyl]-1,3,4-thiadiazole-2-carboxamide IUPAC Name: N-(4-fluorophenyl)-5-[4-(pyridin-3-ylmethylcarbamoyl)piperidine-1-carbonyl]-1,3,4-thiadiazole-2-carboxamide Traditional Name: N-(4-fluorophenyl)-5-[4-(3-pyridylmethylcarbamoyl)piperidine-1-carbonyl]-1,3,4-thiadiazole-2-carboxamide Formula: C22H21FN6O3S MolecularWeight: 468.503943

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NCC2=CN=CC=C2)C(=O)C3=NN=C(S3)C(=O)NC4=CC=C(C=C4)F

Isomeric SMILES

C1CN(CCC1C(=O)NCC2=CN=CC=C2)C(=O)C3=NN=C(S3)C(=O)NC4=CC=C(C=C4)F

InChI

InChI=1S/C22H21FN6O3S/c23-16-3-5-17(6-4-16)26-19(31)20-27-28-21(33-20)22(32)29-10-7-15(8-11-29)18(30)25-13-14-2-1-9-24-12-14/h1-6,9,12,15H,7-8,10-11,13H2,(H,25,30)(H,26,31)