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

Systemtic Name: (3-nitro-4-pyrrolidin-1-yl-phenyl)-[4-[(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methyl]piperazin-1-yl]methanone Openeye Name: (3-nitro-4-pyrrolidin-1-yl-phenyl)-[4-[[3-(2-thienyl)-1,2,4-oxadiazol-5-yl]methyl]piperazin-1-yl]methanone CAS Name: [3-nitro-4-(1-pyrrolidinyl)phenyl]-[4-[(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methyl]-1-piperazinyl]methanone IUPAC Name: (3-nitro-4-pyrrolidin-1-ylphenyl)-[4-[(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methyl]piperazin-1-yl]methanone Traditional Name: (3-nitro-4-pyrrolidino-phenyl)-[4-[[3-(2-thienyl)-1,2,4-oxadiazol-5-yl]methyl]piperazino]methanone Formula: C22H24N6O4S MolecularWeight: 468.52876

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=C(C=C(C=C2)C(=O)N3CCN(CC3)CC4=NC(=NO4)C5=CC=CS5)[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)C2=C(C=C(C=C2)C(=O)N3CCN(CC3)CC4=NC(=NO4)C5=CC=CS5)[N+](=O)[O-]

InChI

InChI=1S/C22H24N6O4S/c29-22(16-5-6-17(18(14-16)28(30)31)26-7-1-2-8-26)27-11-9-25(10-12-27)15-20-23-21(24-32-20)19-4-3-13-33-19/h3-6,13-14H,1-2,7-12,15H2