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

Systemtic Name: N-[3-(3H-benzimidazol-5-yl)-1-(4-methylpiperidin-1-yl)-1-oxidanylidene-propan-2-yl]-4-chloranyl-3-nitro-benzenesulfonamide Openeye Name: N-[1-(3H-benzimidazol-5-ylmethyl)-2-(4-methyl-1-piperidyl)-2-oxo-ethyl]-4-chloro-3-nitro-benzenesulfonamide CAS Name: N-[3-(3H-benzimidazol-5-yl)-1-(4-methyl-1-piperidinyl)-1-oxopropan-2-yl]-4-chloro-3-nitrobenzenesulfonamide IUPAC Name: N-[3-(3H-benzimidazol-5-yl)-1-(4-methylpiperidin-1-yl)-1-oxopropan-2-yl]-4-chloro-3-nitrobenzenesulfonamide Traditional Name: N-[1-(3H-benzimidazol-5-ylmethyl)-2-keto-2-(4-methylpiperidino)ethyl]-4-chloro-3-nitro-benzenesulfonamide Formula: C22H24ClN5O5S MolecularWeight: 505.97446

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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(=C(C=C4)Cl)[N+](=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C22H24ClN5O5S/c1-14-6-8-27(9-7-14)22(29)20(11-15-2-5-18-19(10-15)25-13-24-18)26-34(32,33)16-3-4-17(23)21(12-16)28(30)31/h2-5,10,12-14,20,26H,6-9,11H2,1H3,(H,24,25)