2-(4-fluorophenyl)-5-[4-(4-methylpiperidin-1-yl)sulfonyl-2-nitro-phenyl]sulfanyl-1,3,4-oxadiazole

Systemtic Name: 2-(4-fluorophenyl)-5-[4-(4-methylpiperidin-1-yl)sulfonyl-2-nitro-phenyl]sulfanyl-1,3,4-oxadiazole Openeye Name: 2-(4-fluorophenyl)-5-[4-[(4-methyl-1-piperidyl)sulfonyl]-2-nitro-phenyl]sulfanyl-1,3,4-oxadiazole CAS Name: 2-(4-fluorophenyl)-5-[[4-[(4-methyl-1-piperidinyl)sulfonyl]-2-nitrophenyl]thio]-1,3,4-oxadiazole IUPAC Name: 2-(4-fluorophenyl)-5-[4-(4-methylpiperidin-1-yl)sulfonyl-2-nitrophenyl]sulfanyl-1,3,4-oxadiazole Traditional Name: 2-(4-fluorophenyl)-5-[[4-(4-methylpiperidino)sulfonyl-2-nitro-phenyl]thio]-1,3,4-oxadiazole Formula: C20H19FN4O5S2 MolecularWeight: 478.517063

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)SC3=NN=C(O3)C4=CC=C(C=C4)F)[N+](=O)[O-]

Isomeric SMILES

CC1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)SC3=NN=C(O3)C4=CC=C(C=C4)F)[N+](=O)[O-]

InChI

InChI=1S/C20H19FN4O5S2/c1-13-8-10-24(11-9-13)32(28,29)16-6-7-18(17(12-16)25(26)27)31-20-23-22-19(30-20)14-2-4-15(21)5-3-14/h2-7,12-13H,8-11H2,1H3