N-(2-methoxy-5-piperidin-1-ylsulfonyl-phenyl)-4-methylsulfonyl-benzamide

Systemtic Name: N-(2-methoxy-5-piperidin-1-ylsulfonyl-phenyl)-4-methylsulfonyl-benzamide Openeye Name: N-[2-methoxy-5-(1-piperidylsulfonyl)phenyl]-4-methylsulfonyl-benzamide CAS Name: N-[2-methoxy-5-(1-piperidinylsulfonyl)phenyl]-4-methylsulfonylbenzamide IUPAC Name: N-(2-methoxy-5-piperidin-1-ylsulfonylphenyl)-4-methylsulfonylbenzamide Traditional Name: 4-mesyl-N-(2-methoxy-5-piperidinosulfonyl-phenyl)benzamide Formula: C20H24N2O6S2 MolecularWeight: 452.54436

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NC(=O)C3=CC=C(C=C3)S(=O)(=O)C

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NC(=O)C3=CC=C(C=C3)S(=O)(=O)C

InChI

InChI=1S/C20H24N2O6S2/c1-28-19-11-10-17(30(26,27)22-12-4-3-5-13-22)14-18(19)21-20(23)15-6-8-16(9-7-15)29(2,24)25/h6-11,14H,3-5,12-13H2,1-2H3,(H,21,23)