N-(2-methyl-5-methylsulfonyl-phenyl)-1-(4-methylphenyl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-(2-methyl-5-methylsulfonyl-phenyl)-1-(4-methylphenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-(2-methyl-5-methylsulfonyl-phenyl)-1-(p-tolylsulfonyl)piperidine-4-carboxamide CAS Name: N-(2-methyl-5-methylsulfonylphenyl)-1-(4-methylphenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-(2-methyl-5-methylsulfonylphenyl)-1-(4-methylphenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-(5-mesyl-2-methyl-phenyl)-1-tosyl-isonipecotamide Formula: C21H26N2O5S2 MolecularWeight: 450.57154

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC3=C(C=CC(=C3)S(=O)(=O)C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC3=C(C=CC(=C3)S(=O)(=O)C)C

InChI

InChI=1S/C21H26N2O5S2/c1-15-4-7-18(8-5-15)30(27,28)23-12-10-17(11-13-23)21(24)22-20-14-19(29(3,25)26)9-6-16(20)2/h4-9,14,17H,10-13H2,1-3H3,(H,22,24)