N-ethyl-4-[4-(6-nitro-1,3-benzothiazol-2-yl)piperazin-1-yl]carbonyl-N-phenyl-benzenesulfonamide

Systemtic Name: N-ethyl-4-[4-(6-nitro-1,3-benzothiazol-2-yl)piperazin-1-yl]carbonyl-N-phenyl-benzenesulfonamide Openeye Name: N-ethyl-4-[4-(6-nitro-1,3-benzothiazol-2-yl)piperazine-1-carbonyl]-N-phenyl-benzenesulfonamide CAS Name: N-ethyl-4-[[4-(6-nitro-1,3-benzothiazol-2-yl)-1-piperazinyl]-oxomethyl]-N-phenylbenzenesulfonamide IUPAC Name: N-ethyl-4-[4-(6-nitro-1,3-benzothiazol-2-yl)piperazine-1-carbonyl]-N-phenylbenzenesulfonamide Traditional Name: N-ethyl-4-[4-(6-nitro-1,3-benzothiazol-2-yl)piperazine-1-carbonyl]-N-phenyl-benzenesulfonamide Formula: C26H25N5O5S2 MolecularWeight: 551.6372

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC=CC=C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)N3CCN(CC3)C4=NC5=C(S4)C=C(C=C5)[N+](=O)[O-]

Isomeric SMILES

CCN(C1=CC=CC=C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)N3CCN(CC3)C4=NC5=C(S4)C=C(C=C5)[N+](=O)[O-]

InChI

InChI=1S/C26H25N5O5S2/c1-2-30(20-6-4-3-5-7-20)38(35,36)22-11-8-19(9-12-22)25(32)28-14-16-29(17-15-28)26-27-23-13-10-21(31(33)34)18-24(23)37-26/h3-13,18H,2,14-17H2,1H3