N-[[5-[3-[(4-methylsulfonylphenyl)amino]piperidin-1-yl]sulfonylthiophen-2-yl]methyl]-4-nitro-benzamide

Systemtic Name: N-[[5-[3-[(4-methylsulfonylphenyl)amino]piperidin-1-yl]sulfonylthiophen-2-yl]methyl]-4-nitro-benzamide Openeye Name: N-[[5-[[3-(4-methylsulfonylanilino)-1-piperidyl]sulfonyl]-2-thienyl]methyl]-4-nitro-benzamide CAS Name: N-[[5-[[3-(4-methylsulfonylanilino)-1-piperidinyl]sulfonyl]-2-thiophenyl]methyl]-4-nitrobenzamide IUPAC Name: N-[[5-[3-(4-methylsulfonylanilino)piperidin-1-yl]sulfonylthiophen-2-yl]methyl]-4-nitrobenzamide Traditional Name: N-[[5-[3-(4-mesylanilino)piperidino]sulfonyl-2-thienyl]methyl]-4-nitro-benzamide Formula: C24H26N4O7S3 MolecularWeight: 578.68084

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)NC2CCCN(C2)S(=O)(=O)C3=CC=C(S3)CNC(=O)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)NC2CCCN(C2)S(=O)(=O)C3=CC=C(S3)CNC(=O)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C24H26N4O7S3/c1-37(32,33)22-11-6-18(7-12-22)26-19-3-2-14-27(16-19)38(34,35)23-13-10-21(36-23)15-25-24(29)17-4-8-20(9-5-17)28(30)31/h4-13,19,26H,2-3,14-16H2,1H3,(H,25,29)