N-[[4-(diethylaminomethyl)phenyl]methyl]-1-(2,4,6-trimethylphenyl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[[4-(diethylaminomethyl)phenyl]methyl]-1-(2,4,6-trimethylphenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-[[4-(diethylaminomethyl)phenyl]methyl]-1-(2,4,6-trimethylphenyl)sulfonyl-piperidine-4-carboxamide CAS Name: N-[[4-(diethylaminomethyl)phenyl]methyl]-1-(2,4,6-trimethylphenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-[[4-(diethylaminomethyl)phenyl]methyl]-1-(2,4,6-trimethylphenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-[4-(diethylaminomethyl)benzyl]-1-mesitylsulfonyl-isonipecotamide Formula: C27H39N3O3S MolecularWeight: 485.68186

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC1=CC=C(C=C1)CNC(=O)C2CCN(CC2)S(=O)(=O)C3=C(C=C(C=C3C)C)C

Isomeric SMILES

CCN(CC)CC1=CC=C(C=C1)CNC(=O)C2CCN(CC2)S(=O)(=O)C3=C(C=C(C=C3C)C)C

InChI

InChI=1S/C27H39N3O3S/c1-6-29(7-2)19-24-10-8-23(9-11-24)18-28-27(31)25-12-14-30(15-13-25)34(32,33)26-21(4)16-20(3)17-22(26)5/h8-11,16-17,25H,6-7,12-15,18-19H2,1-5H3,(H,28,31)