2-[[4-(2-nitrophenyl)-3-piperazin-1-ylsulfonyl-thiophen-2-yl]methyl]benzamide

Systemtic Name: 2-[[4-(2-nitrophenyl)-3-piperazin-1-ylsulfonyl-thiophen-2-yl]methyl]benzamide Openeye Name: 2-[[4-(2-nitrophenyl)-3-piperazin-1-ylsulfonyl-2-thienyl]methyl]benzamide CAS Name: 2-[[4-(2-nitrophenyl)-3-(1-piperazinylsulfonyl)-2-thiophenyl]methyl]benzamide IUPAC Name: 2-[[4-(2-nitrophenyl)-3-piperazin-1-ylsulfonylthiophen-2-yl]methyl]benzamide Traditional Name: 2-[[4-(2-nitrophenyl)-3-piperazinosulfonyl-2-thienyl]methyl]benzamide Formula: C22H22N4O5S2 MolecularWeight: 486.56388

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)S(=O)(=O)C2=C(SC=C2C3=CC=CC=C3[N+](=O)[O-])CC4=CC=CC=C4C(=O)N

Isomeric SMILES

C1CN(CCN1)S(=O)(=O)C2=C(SC=C2C3=CC=CC=C3[N+](=O)[O-])CC4=CC=CC=C4C(=O)N

InChI

InChI=1S/C22H22N4O5S2/c23-22(27)16-6-2-1-5-15(16)13-20-21(33(30,31)25-11-9-24-10-12-25)18(14-32-20)17-7-3-4-8-19(17)26(28)29/h1-8,14,24H,9-13H2,(H2,23,27)