N-(3,5-dimethylphenyl)-1-(2,4-dimethylphenyl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-(3,5-dimethylphenyl)-1-(2,4-dimethylphenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-(3,5-dimethylphenyl)-1-(2,4-dimethylphenyl)sulfonyl-piperidine-4-carboxamide CAS Name: N-(3,5-dimethylphenyl)-1-(2,4-dimethylphenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-(3,5-dimethylphenyl)-1-(2,4-dimethylphenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-(3,5-dimethylphenyl)-1-(2,4-dimethylphenyl)sulfonyl-isonipecotamide Formula: C22H28N2O3S MolecularWeight: 400.53432

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H28N2O3S/c1-15-5-6-21(18(4)12-15)28(26,27)24-9-7-19(8-10-24)22(25)23-20-13-16(2)11-17(3)14-20/h5-6,11-14,19H,7-10H2,1-4H3,(H,23,25)