(4-nitro-3-oxidanyl-phenyl)-[4-[(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methyl]piperazin-1-yl]methanone

Systemtic Name: (4-nitro-3-oxidanyl-phenyl)-[4-[(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methyl]piperazin-1-yl]methanone Openeye Name: (3-hydroxy-4-nitro-phenyl)-[4-[[3-(2-thienyl)-1,2,4-oxadiazol-5-yl]methyl]piperazin-1-yl]methanone CAS Name: (3-hydroxy-4-nitrophenyl)-[4-[(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methyl]-1-piperazinyl]methanone IUPAC Name: (3-hydroxy-4-nitrophenyl)-[4-[(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methyl]piperazin-1-yl]methanone Traditional Name: (3-hydroxy-4-nitro-phenyl)-[4-[[3-(2-thienyl)-1,2,4-oxadiazol-5-yl]methyl]piperazino]methanone Formula: C18H17N5O5S MolecularWeight: 415.42308

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=NC(=NO2)C3=CC=CS3)C(=O)C4=CC(=C(C=C4)[N+](=O)[O-])O

Isomeric SMILES

C1CN(CCN1CC2=NC(=NO2)C3=CC=CS3)C(=O)C4=CC(=C(C=C4)[N+](=O)[O-])O

InChI

InChI=1S/C18H17N5O5S/c24-14-10-12(3-4-13(14)23(26)27)18(25)22-7-5-21(6-8-22)11-16-19-17(20-28-16)15-2-1-9-29-15/h1-4,9-10,24H,5-8,11H2