N-(5-tert-butyl-2-methoxy-phenyl)-1-(3,4-dimethylphenyl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-(5-tert-butyl-2-methoxy-phenyl)-1-(3,4-dimethylphenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-(5-tert-butyl-2-methoxy-phenyl)-1-(3,4-dimethylphenyl)sulfonyl-piperidine-4-carboxamide CAS Name: N-(5-tert-butyl-2-methoxyphenyl)-1-(3,4-dimethylphenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-(5-tert-butyl-2-methoxyphenyl)-1-(3,4-dimethylphenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-(5-tert-butyl-2-methoxy-phenyl)-1-(3,4-dimethylphenyl)sulfonyl-isonipecotamide Formula: C25H34N2O4S MolecularWeight: 458.61346

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H34N2O4S/c1-17-7-9-21(15-18(17)2)32(29,30)27-13-11-19(12-14-27)24(28)26-22-16-20(25(3,4)5)8-10-23(22)31-6/h7-10,15-16,19H,11-14H2,1-6H3,(H,26,28)