N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-1-thiophen-2-ylsulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-1-thiophen-2-ylsulfonyl-piperidine-4-carboxamide Openeye Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-1-(2-thienylsulfonyl)piperidine-4-carboxamide CAS Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-1-thiophen-2-ylsulfonyl-4-piperidinecarboxamide IUPAC Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-1-thiophen-2-ylsulfonylpiperidine-4-carboxamide Traditional Name: N-homoveratryl-N-methyl-1-(2-thienylsulfonyl)isonipecotamide Formula: C21H28N2O5S2 MolecularWeight: 452.58742

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC1=CC(=C(C=C1)OC)OC)C(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CS3

Isomeric SMILES

CN(CCC1=CC(=C(C=C1)OC)OC)C(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CS3

InChI

InChI=1S/C21H28N2O5S2/c1-22(11-8-16-6-7-18(27-2)19(15-16)28-3)21(24)17-9-12-23(13-10-17)30(25,26)20-5-4-14-29-20/h4-7,14-15,17H,8-13H2,1-3H3