N-[(4-ethoxyphenyl)methyl]-N-methyl-1-(5-methylthiophen-2-yl)sulfonyl-piperidine-3-carboxamide

Systemtic Name: N-[(4-ethoxyphenyl)methyl]-N-methyl-1-(5-methylthiophen-2-yl)sulfonyl-piperidine-3-carboxamide Openeye Name: N-[(4-ethoxyphenyl)methyl]-N-methyl-1-[(5-methyl-2-thienyl)sulfonyl]piperidine-3-carboxamide CAS Name: N-[(4-ethoxyphenyl)methyl]-N-methyl-1-[(5-methyl-2-thiophenyl)sulfonyl]-3-piperidinecarboxamide IUPAC Name: N-[(4-ethoxyphenyl)methyl]-N-methyl-1-(5-methylthiophen-2-yl)sulfonylpiperidine-3-carboxamide Traditional Name: N-(4-ethoxybenzyl)-N-methyl-1-[(5-methyl-2-thienyl)sulfonyl]nipecotamide Formula: C21H28N2O4S2 MolecularWeight: 436.58802

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)CN(C)C(=O)C2CCCN(C2)S(=O)(=O)C3=CC=C(S3)C

Isomeric SMILES

CCOC1=CC=C(C=C1)CN(C)C(=O)C2CCCN(C2)S(=O)(=O)C3=CC=C(S3)C

InChI

InChI=1S/C21H28N2O4S2/c1-4-27-19-10-8-17(9-11-19)14-22(3)21(24)18-6-5-13-23(15-18)29(25,26)20-12-7-16(2)28-20/h7-12,18H,4-6,13-15H2,1-3H3