N-[(4-tert-butylphenyl)methyl]-N-methyl-1-(4-methylphenyl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[(4-tert-butylphenyl)methyl]-N-methyl-1-(4-methylphenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-[(4-tert-butylphenyl)methyl]-N-methyl-1-(p-tolylsulfonyl)piperidine-4-carboxamide CAS Name: N-[(4-tert-butylphenyl)methyl]-N-methyl-1-(4-methylphenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-[(4-tert-butylphenyl)methyl]-N-methyl-1-(4-methylphenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-(4-tert-butylbenzyl)-N-methyl-1-tosyl-isonipecotamide Formula: C25H34N2O3S MolecularWeight: 442.61406

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)N(C)CC3=CC=C(C=C3)C(C)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)N(C)CC3=CC=C(C=C3)C(C)(C)C

InChI

InChI=1S/C25H34N2O3S/c1-19-6-12-23(13-7-19)31(29,30)27-16-14-21(15-17-27)24(28)26(5)18-20-8-10-22(11-9-20)25(2,3)4/h6-13,21H,14-18H2,1-5H3