5-[(3S)-1-(3-nitrophenyl)sulfonylpiperidin-3-yl]-3-thiophen-2-yl-1,2,4-oxadiazole

Systemtic Name: 5-[(3S)-1-(3-nitrophenyl)sulfonylpiperidin-3-yl]-3-thiophen-2-yl-1,2,4-oxadiazole Openeye Name: 5-[(3S)-1-(3-nitrophenyl)sulfonyl-3-piperidyl]-3-(2-thienyl)-1,2,4-oxadiazole CAS Name: 5-[(3S)-1-(3-nitrophenyl)sulfonyl-3-piperidinyl]-3-thiophen-2-yl-1,2,4-oxadiazole IUPAC Name: 5-[(3S)-1-(3-nitrophenyl)sulfonylpiperidin-3-yl]-3-thiophen-2-yl-1,2,4-oxadiazole Traditional Name: 5-[(3S)-1-(3-nitrophenyl)sulfonyl-3-piperidyl]-3-(2-thienyl)-1,2,4-oxadiazole Formula: C17H16N4O5S2 MolecularWeight: 420.46274

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)S(=O)(=O)C2=CC=CC(=C2)[N+](=O)[O-])C3=NC(=NO3)C4=CC=CS4

Isomeric SMILES

C1C[C@@H](CN(C1)S(=O)(=O)C2=CC=CC(=C2)[N+](=O)[O-])C3=NC(=NO3)C4=CC=CS4

InChI

InChI=1S/C17H16N4O5S2/c22-21(23)13-5-1-6-14(10-13)28(24,25)20-8-2-4-12(11-20)17-18-16(19-26-17)15-7-3-9-27-15/h1,3,5-7,9-10,12H,2,4,8,11H2/t12-/m0/s1