N-[2-(3,4-dimethoxyphenyl)-2-morpholin-4-yl-ethyl]-1-thiophen-2-ylcarbonyl-piperidine-3-carboxamide

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)-2-morpholin-4-yl-ethyl]-1-thiophen-2-ylcarbonyl-piperidine-3-carboxamide Openeye Name: N-[2-(3,4-dimethoxyphenyl)-2-morpholino-ethyl]-1-(thiophene-2-carbonyl)piperidine-3-carboxamide CAS Name: N-[2-(3,4-dimethoxyphenyl)-2-(4-morpholinyl)ethyl]-1-[oxo(thiophen-2-yl)methyl]-3-piperidinecarboxamide IUPAC Name: N-[2-(3,4-dimethoxyphenyl)-2-morpholin-4-ylethyl]-1-(thiophene-2-carbonyl)piperidine-3-carboxamide Traditional Name: N-[2-(3,4-dimethoxyphenyl)-2-morpholino-ethyl]-1-(2-thenoyl)nipecotamide Formula: C25H33N3O5S MolecularWeight: 487.61162

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(CNC(=O)C2CCCN(C2)C(=O)C3=CC=CS3)N4CCOCC4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(CNC(=O)C2CCCN(C2)C(=O)C3=CC=CS3)N4CCOCC4)OC

InChI

InChI=1S/C25H33N3O5S/c1-31-21-8-7-18(15-22(21)32-2)20(27-10-12-33-13-11-27)16-26-24(29)19-5-3-9-28(17-19)25(30)23-6-4-14-34-23/h4,6-8,14-15,19-20H,3,5,9-13,16-17H2,1-2H3,(H,26,29)