2-[(3-phenyl-1,2,4-oxadiazol-5-yl)methylsulfanyl]-5-piperidin-1-ylsulfonyl-1,3-benzoxazole

Systemtic Name: 2-[(3-phenyl-1,2,4-oxadiazol-5-yl)methylsulfanyl]-5-piperidin-1-ylsulfonyl-1,3-benzoxazole Openeye Name: 2-[(3-phenyl-1,2,4-oxadiazol-5-yl)methylsulfanyl]-5-(1-piperidylsulfonyl)-1,3-benzoxazole CAS Name: 2-[(3-phenyl-1,2,4-oxadiazol-5-yl)methylthio]-5-(1-piperidinylsulfonyl)-1,3-benzoxazole IUPAC Name: 2-[(3-phenyl-1,2,4-oxadiazol-5-yl)methylsulfanyl]-5-piperidin-1-ylsulfonyl-1,3-benzoxazole Traditional Name: 2-[(3-phenyl-1,2,4-oxadiazol-5-yl)methylthio]-5-piperidinosulfonyl-1,3-benzoxazole Formula: C21H20N4O4S2 MolecularWeight: 456.5379

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC3=C(C=C2)OC(=N3)SCC4=NC(=NO4)C5=CC=CC=C5

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC3=C(C=C2)OC(=N3)SCC4=NC(=NO4)C5=CC=CC=C5

InChI

InChI=1S/C21H20N4O4S2/c26-31(27,25-11-5-2-6-12-25)16-9-10-18-17(13-16)22-21(28-18)30-14-19-23-20(24-29-19)15-7-3-1-4-8-15/h1,3-4,7-10,13H,2,5-6,11-12,14H2