N-[2-(4-methylpiperazin-1-yl)phenyl]-2-methylsulfanyl-pyridine-3-carboxamide

Systemtic Name: N-[2-(4-methylpiperazin-1-yl)phenyl]-2-methylsulfanyl-pyridine-3-carboxamide Openeye Name: N-[2-(4-methylpiperazin-1-yl)phenyl]-2-methylsulfanyl-pyridine-3-carboxamide CAS Name: N-[2-(4-methyl-1-piperazinyl)phenyl]-2-(methylthio)-3-pyridinecarboxamide IUPAC Name: N-[2-(4-methylpiperazin-1-yl)phenyl]-2-methylsulfanylpyridine-3-carboxamide Traditional Name: N-[2-(4-methylpiperazino)phenyl]-2-(methylthio)nicotinamide Formula: C18H22N4OS MolecularWeight: 342.45848

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=CC=CC=C2NC(=O)C3=C(N=CC=C3)SC

Isomeric SMILES

CN1CCN(CC1)C2=CC=CC=C2NC(=O)C3=C(N=CC=C3)SC

InChI

InChI=1S/C18H22N4OS/c1-21-10-12-22(13-11-21)16-8-4-3-7-15(16)20-17(23)14-6-5-9-19-18(14)24-2/h3-9H,10-13H2,1-2H3,(H,20,23)