3-[4-(2-nitrophenyl)piperazin-1-yl]carbonyl-N-(thiophen-2-ylmethyl)benzenesulfonamide

Systemtic Name: 3-[4-(2-nitrophenyl)piperazin-1-yl]carbonyl-N-(thiophen-2-ylmethyl)benzenesulfonamide Openeye Name: 3-[4-(2-nitrophenyl)piperazine-1-carbonyl]-N-(2-thienylmethyl)benzenesulfonamide CAS Name: 3-[[4-(2-nitrophenyl)-1-piperazinyl]-oxomethyl]-N-(thiophen-2-ylmethyl)benzenesulfonamide IUPAC Name: 3-[4-(2-nitrophenyl)piperazine-1-carbonyl]-N-(thiophen-2-ylmethyl)benzenesulfonamide Traditional Name: 3-[4-(2-nitrophenyl)piperazine-1-carbonyl]-N-(2-thenyl)benzenesulfonamide Formula: C22H22N4O5S2 MolecularWeight: 486.56388

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2[N+](=O)[O-])C(=O)C3=CC(=CC=C3)S(=O)(=O)NCC4=CC=CS4

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2[N+](=O)[O-])C(=O)C3=CC(=CC=C3)S(=O)(=O)NCC4=CC=CS4

InChI

InChI=1S/C22H22N4O5S2/c27-22(25-12-10-24(11-13-25)20-8-1-2-9-21(20)26(28)29)17-5-3-7-19(15-17)33(30,31)23-16-18-6-4-14-32-18/h1-9,14-15,23H,10-13,16H2