5-nitro-2-[4-(thiophen-3-ylmethyl)piperazin-1-yl]benzenesulfonamide

Systemtic Name: 5-nitro-2-[4-(thiophen-3-ylmethyl)piperazin-1-yl]benzenesulfonamide Openeye Name: 5-nitro-2-[4-(3-thienylmethyl)piperazin-1-yl]benzenesulfonamide CAS Name: 5-nitro-2-[4-(3-thiophenylmethyl)-1-piperazinyl]benzenesulfonamide IUPAC Name: 5-nitro-2-[4-(thiophen-3-ylmethyl)piperazin-1-yl]benzenesulfonamide Traditional Name: 5-nitro-2-[4-(3-thenyl)piperazino]benzenesulfonamide Formula: C15H18N4O4S2 MolecularWeight: 382.45782

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CSC=C2)C3=C(C=C(C=C3)[N+](=O)[O-])S(=O)(=O)N

Isomeric SMILES

C1CN(CCN1CC2=CSC=C2)C3=C(C=C(C=C3)[N+](=O)[O-])S(=O)(=O)N

InChI

InChI=1S/C15H18N4O4S2/c16-25(22,23)15-9-13(19(20)21)1-2-14(15)18-6-4-17(5-7-18)10-12-3-8-24-11-12/h1-3,8-9,11H,4-7,10H2,(H2,16,22,23)