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

Systemtic Name: 5-[1-(phenylmethyl)sulfonylpiperidin-3-yl]-3-thiophen-2-yl-1,2,4-oxadiazole Openeye Name: 5-(1-benzylsulfonyl-3-piperidyl)-3-(2-thienyl)-1,2,4-oxadiazole CAS Name: 5-[1-(phenylmethyl)sulfonyl-3-piperidinyl]-3-thiophen-2-yl-1,2,4-oxadiazole IUPAC Name: 5-(1-benzylsulfonylpiperidin-3-yl)-3-thiophen-2-yl-1,2,4-oxadiazole Traditional Name: 5-(1-benzylsulfonyl-3-piperidyl)-3-(2-thienyl)-1,2,4-oxadiazole Formula: C18H19N3O3S2 MolecularWeight: 389.49176

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)S(=O)(=O)CC2=CC=CC=C2)C3=NC(=NO3)C4=CC=CS4

Isomeric SMILES

C1CC(CN(C1)S(=O)(=O)CC2=CC=CC=C2)C3=NC(=NO3)C4=CC=CS4

InChI

InChI=1S/C18H19N3O3S2/c22-26(23,13-14-6-2-1-3-7-14)21-10-4-8-15(12-21)18-19-17(20-24-18)16-9-5-11-25-16/h1-3,5-7,9,11,15H,4,8,10,12-13H2