N-[(4-tert-butylphenyl)methyl]-1-(3,4-dimethoxyphenyl)sulfonyl-N-methyl-piperidine-4-carboxamide

Systemtic Name: N-[(4-tert-butylphenyl)methyl]-1-(3,4-dimethoxyphenyl)sulfonyl-N-methyl-piperidine-4-carboxamide Openeye Name: N-[(4-tert-butylphenyl)methyl]-1-(3,4-dimethoxyphenyl)sulfonyl-N-methyl-piperidine-4-carboxamide CAS Name: N-[(4-tert-butylphenyl)methyl]-1-(3,4-dimethoxyphenyl)sulfonyl-N-methyl-4-piperidinecarboxamide IUPAC Name: N-[(4-tert-butylphenyl)methyl]-1-(3,4-dimethoxyphenyl)sulfonyl-N-methylpiperidine-4-carboxamide Traditional Name: N-(4-tert-butylbenzyl)-1-(3,4-dimethoxyphenyl)sulfonyl-N-methyl-isonipecotamide Formula: C26H36N2O5S MolecularWeight: 488.63944

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H36N2O5S/c1-26(2,3)21-9-7-19(8-10-21)18-27(4)25(29)20-13-15-28(16-14-20)34(30,31)22-11-12-23(32-5)24(17-22)33-6/h7-12,17,20H,13-16,18H2,1-6H3