N-[[2-(propan-2-yloxymethyl)phenyl]methyl]-1-thiophen-2-ylsulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[[2-(propan-2-yloxymethyl)phenyl]methyl]-1-thiophen-2-ylsulfonyl-piperidine-4-carboxamide Openeye Name: N-[[2-(isopropoxymethyl)phenyl]methyl]-1-(2-thienylsulfonyl)piperidine-4-carboxamide CAS Name: N-[[2-(propan-2-yloxymethyl)phenyl]methyl]-1-thiophen-2-ylsulfonyl-4-piperidinecarboxamide IUPAC Name: N-[[2-(propan-2-yloxymethyl)phenyl]methyl]-1-thiophen-2-ylsulfonylpiperidine-4-carboxamide Traditional Name: N-[2-(isopropoxymethyl)benzyl]-1-(2-thienylsulfonyl)isonipecotamide Formula: C21H28N2O4S2 MolecularWeight: 436.58802

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OCC1=CC=CC=C1CNC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CS3

Isomeric SMILES

CC(C)OCC1=CC=CC=C1CNC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CS3

InChI

InChI=1S/C21H28N2O4S2/c1-16(2)27-15-19-7-4-3-6-18(19)14-22-21(24)17-9-11-23(12-10-17)29(25,26)20-8-5-13-28-20/h3-8,13,16-17H,9-12,14-15H2,1-2H3,(H,22,24)