N-[3-(3H-benzimidazol-5-yl)-1-(4-methylpiperidin-1-yl)-1-oxidanylidene-propan-2-yl]-2-nitro-benzenesulfonamide

Systemtic Name: N-[3-(3H-benzimidazol-5-yl)-1-(4-methylpiperidin-1-yl)-1-oxidanylidene-propan-2-yl]-2-nitro-benzenesulfonamide Openeye Name: N-[1-(3H-benzimidazol-5-ylmethyl)-2-(4-methyl-1-piperidyl)-2-oxo-ethyl]-2-nitro-benzenesulfonamide CAS Name: N-[3-(3H-benzimidazol-5-yl)-1-(4-methyl-1-piperidinyl)-1-oxopropan-2-yl]-2-nitrobenzenesulfonamide IUPAC Name: N-[3-(3H-benzimidazol-5-yl)-1-(4-methylpiperidin-1-yl)-1-oxopropan-2-yl]-2-nitrobenzenesulfonamide Traditional Name: N-[1-(3H-benzimidazol-5-ylmethyl)-2-keto-2-(4-methylpiperidino)ethyl]-2-nitro-benzenesulfonamide Formula: C22H25N5O5S MolecularWeight: 471.5294

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C(=O)C(CC2=CC3=C(C=C2)N=CN3)NS(=O)(=O)C4=CC=CC=C4[N+](=O)[O-]

Isomeric SMILES

CC1CCN(CC1)C(=O)C(CC2=CC3=C(C=C2)N=CN3)NS(=O)(=O)C4=CC=CC=C4[N+](=O)[O-]

InChI

InChI=1S/C22H25N5O5S/c1-15-8-10-26(11-9-15)22(28)19(13-16-6-7-17-18(12-16)24-14-23-17)25-33(31,32)21-5-3-2-4-20(21)27(29)30/h2-7,12,14-15,19,25H,8-11,13H2,1H3,(H,23,24)