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

Systemtic Name: N-[2-(2,4-dimethylphenoxy)ethyl]-1-thiophen-2-ylsulfonyl-piperidine-3-carboxamide Openeye Name: N-[2-(2,4-dimethylphenoxy)ethyl]-1-(2-thienylsulfonyl)piperidine-3-carboxamide CAS Name: N-[2-(2,4-dimethylphenoxy)ethyl]-1-thiophen-2-ylsulfonyl-3-piperidinecarboxamide IUPAC Name: N-[2-(2,4-dimethylphenoxy)ethyl]-1-thiophen-2-ylsulfonylpiperidine-3-carboxamide Traditional Name: N-[2-(2,4-dimethylphenoxy)ethyl]-1-(2-thienylsulfonyl)nipecotamide Formula: C20H26N2O4S2 MolecularWeight: 422.56144

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H26N2O4S2/c1-15-7-8-18(16(2)13-15)26-11-9-21-20(23)17-5-3-10-22(14-17)28(24,25)19-6-4-12-27-19/h4,6-8,12-13,17H,3,5,9-11,14H2,1-2H3,(H,21,23)