2-cyclohexyl-5-(2-nitro-4-piperidin-1-ylsulfonyl-phenyl)sulfanyl-1,3,4-oxadiazole

Systemtic Name: 2-cyclohexyl-5-(2-nitro-4-piperidin-1-ylsulfonyl-phenyl)sulfanyl-1,3,4-oxadiazole Openeye Name: 2-cyclohexyl-5-[2-nitro-4-(1-piperidylsulfonyl)phenyl]sulfanyl-1,3,4-oxadiazole CAS Name: 2-cyclohexyl-5-[[2-nitro-4-(1-piperidinylsulfonyl)phenyl]thio]-1,3,4-oxadiazole IUPAC Name: 2-cyclohexyl-5-(2-nitro-4-piperidin-1-ylsulfonylphenyl)sulfanyl-1,3,4-oxadiazole Traditional Name: 2-cyclohexyl-5-[(2-nitro-4-piperidinosulfonyl-phenyl)thio]-1,3,4-oxadiazole Formula: C19H24N4O5S2 MolecularWeight: 452.54766

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2=NN=C(O2)SC3=C(C=C(C=C3)S(=O)(=O)N4CCCCC4)[N+](=O)[O-]

Isomeric SMILES

C1CCC(CC1)C2=NN=C(O2)SC3=C(C=C(C=C3)S(=O)(=O)N4CCCCC4)[N+](=O)[O-]

InChI

InChI=1S/C19H24N4O5S2/c24-23(25)16-13-15(30(26,27)22-11-5-2-6-12-22)9-10-17(16)29-19-21-20-18(28-19)14-7-3-1-4-8-14/h9-10,13-14H,1-8,11-12H2