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

Systemtic Name: 2-(2-nitro-4-piperidin-1-ylsulfonyl-phenyl)sulfanyl-5-thiophen-2-yl-1,3,4-oxadiazole Openeye Name: 2-[2-nitro-4-(1-piperidylsulfonyl)phenyl]sulfanyl-5-(2-thienyl)-1,3,4-oxadiazole CAS Name: 2-[[2-nitro-4-(1-piperidinylsulfonyl)phenyl]thio]-5-thiophen-2-yl-1,3,4-oxadiazole IUPAC Name: 2-(2-nitro-4-piperidin-1-ylsulfonylphenyl)sulfanyl-5-thiophen-2-yl-1,3,4-oxadiazole Traditional Name: 2-[(2-nitro-4-piperidinosulfonyl-phenyl)thio]-5-(2-thienyl)-1,3,4-oxadiazole Formula: C17H16N4O5S3 MolecularWeight: 452.52774

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)SC3=NN=C(O3)C4=CC=CS4)[N+](=O)[O-]

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)SC3=NN=C(O3)C4=CC=CS4)[N+](=O)[O-]

InChI

InChI=1S/C17H16N4O5S3/c22-21(23)13-11-12(29(24,25)20-8-2-1-3-9-20)6-7-14(13)28-17-19-18-16(26-17)15-5-4-10-27-15/h4-7,10-11H,1-3,8-9H2