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

Systemtic Name: N-[(3,4-dimethoxyphenyl)methyl]-N-methyl-1-thiophen-2-ylsulfonyl-piperidine-3-carboxamide Openeye Name: N-[(3,4-dimethoxyphenyl)methyl]-N-methyl-1-(2-thienylsulfonyl)piperidine-3-carboxamide CAS Name: N-[(3,4-dimethoxyphenyl)methyl]-N-methyl-1-thiophen-2-ylsulfonyl-3-piperidinecarboxamide IUPAC Name: N-[(3,4-dimethoxyphenyl)methyl]-N-methyl-1-thiophen-2-ylsulfonylpiperidine-3-carboxamide Traditional Name: N-methyl-1-(2-thienylsulfonyl)-N-veratryl-nipecotamide Formula: C20H26N2O5S2 MolecularWeight: 438.56084

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC(=C(C=C1)OC)OC)C(=O)C2CCCN(C2)S(=O)(=O)C3=CC=CS3

Isomeric SMILES

CN(CC1=CC(=C(C=C1)OC)OC)C(=O)C2CCCN(C2)S(=O)(=O)C3=CC=CS3

InChI

InChI=1S/C20H26N2O5S2/c1-21(13-15-8-9-17(26-2)18(12-15)27-3)20(23)16-6-4-10-22(14-16)29(24,25)19-7-5-11-28-19/h5,7-9,11-12,16H,4,6,10,13-14H2,1-3H3