2-(2-fluorophenyl)-5-[1-(3-nitrophenyl)sulfonylpiperidin-3-yl]-1,3,4-thiadiazole

Systemtic Name: 2-(2-fluorophenyl)-5-[1-(3-nitrophenyl)sulfonylpiperidin-3-yl]-1,3,4-thiadiazole Openeye Name: 2-(2-fluorophenyl)-5-[1-(3-nitrophenyl)sulfonyl-3-piperidyl]-1,3,4-thiadiazole CAS Name: 2-(2-fluorophenyl)-5-[1-(3-nitrophenyl)sulfonyl-3-piperidinyl]-1,3,4-thiadiazole IUPAC Name: 2-(2-fluorophenyl)-5-[1-(3-nitrophenyl)sulfonylpiperidin-3-yl]-1,3,4-thiadiazole Traditional Name: 2-(2-fluorophenyl)-5-[1-(3-nitrophenyl)sulfonyl-3-piperidyl]-1,3,4-thiadiazole Formula: C19H17FN4O4S2 MolecularWeight: 448.491083

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)S(=O)(=O)C2=CC=CC(=C2)[N+](=O)[O-])C3=NN=C(S3)C4=CC=CC=C4F

Isomeric SMILES

C1CC(CN(C1)S(=O)(=O)C2=CC=CC(=C2)[N+](=O)[O-])C3=NN=C(S3)C4=CC=CC=C4F

InChI

InChI=1S/C19H17FN4O4S2/c20-17-9-2-1-8-16(17)19-22-21-18(29-19)13-5-4-10-23(12-13)30(27,28)15-7-3-6-14(11-15)24(25)26/h1-3,6-9,11,13H,4-5,10,12H2