N-(2,5-dimethylphenyl)-1-(2-methoxy-5-methyl-phenyl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-(2,5-dimethylphenyl)-1-(2-methoxy-5-methyl-phenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-(2,5-dimethylphenyl)-1-(2-methoxy-5-methyl-phenyl)sulfonyl-piperidine-4-carboxamide CAS Name: N-(2,5-dimethylphenyl)-1-(2-methoxy-5-methylphenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-(2,5-dimethylphenyl)-1-(2-methoxy-5-methylphenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-(2,5-dimethylphenyl)-1-(2-methoxy-5-methyl-phenyl)sulfonyl-isonipecotamide Formula: C22H28N2O4S MolecularWeight: 416.53372

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)NC(=O)C2CCN(CC2)S(=O)(=O)C3=C(C=CC(=C3)C)OC

Isomeric SMILES

CC1=CC(=C(C=C1)C)NC(=O)C2CCN(CC2)S(=O)(=O)C3=C(C=CC(=C3)C)OC

InChI

InChI=1S/C22H28N2O4S/c1-15-5-7-17(3)19(13-15)23-22(25)18-9-11-24(12-10-18)29(26,27)21-14-16(2)6-8-20(21)28-4/h5-8,13-14,18H,9-12H2,1-4H3,(H,23,25)