N-[2-(3,4-dimethoxyphenyl)-2-morpholin-4-yl-ethyl]-2-sulfanylidene-1H-pyridine-3-carboxamide

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)-2-morpholin-4-yl-ethyl]-2-sulfanylidene-1H-pyridine-3-carboxamide Openeye Name: N-[2-(3,4-dimethoxyphenyl)-2-morpholino-ethyl]-2-thioxo-1H-pyridine-3-carboxamide CAS Name: N-[2-(3,4-dimethoxyphenyl)-2-(4-morpholinyl)ethyl]-2-sulfanylidene-1H-pyridine-3-carboxamide IUPAC Name: N-[2-(3,4-dimethoxyphenyl)-2-morpholin-4-ylethyl]-2-sulfanylidene-1H-pyridine-3-carboxamide Traditional Name: N-[2-(3,4-dimethoxyphenyl)-2-morpholino-ethyl]-2-thioxo-1H-pyridine-3-carboxamide Formula: C20H25N3O4S MolecularWeight: 403.4952

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(CNC(=O)C2=CC=CNC2=S)N3CCOCC3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(CNC(=O)C2=CC=CNC2=S)N3CCOCC3)OC

InChI

InChI=1S/C20H25N3O4S/c1-25-17-6-5-14(12-18(17)26-2)16(23-8-10-27-11-9-23)13-22-19(24)15-4-3-7-21-20(15)28/h3-7,12,16H,8-11,13H2,1-2H3,(H,21,28)(H,22,24)