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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCOCC1=CC=C(C=C1)CNC(=O)C2CCCN(C2)S(=O)(=O)C3=CC=C(S3)C

Isomeric SMILES

CCOCC1=CC=C(C=C1)CNC(=O)C2CCCN(C2)S(=O)(=O)C3=CC=C(S3)C

InChI

InChI=1S/C21H28N2O4S2/c1-3-27-15-18-9-7-17(8-10-18)13-22-21(24)19-5-4-12-23(14-19)29(25,26)20-11-6-16(2)28-20/h6-11,19H,3-5,12-15H2,1-2H3,(H,22,24)