6-(3-methylpiperazin-1-yl)-N-(3-methylsulfanylphenyl)pyridine-3-carboxamide

Systemtic Name: 6-(3-methylpiperazin-1-yl)-N-(3-methylsulfanylphenyl)pyridine-3-carboxamide Openeye Name: 6-(3-methylpiperazin-1-yl)-N-(3-methylsulfanylphenyl)pyridine-3-carboxamide CAS Name: 6-(3-methyl-1-piperazinyl)-N-[3-(methylthio)phenyl]-3-pyridinecarboxamide IUPAC Name: 6-(3-methylpiperazin-1-yl)-N-(3-methylsulfanylphenyl)pyridine-3-carboxamide Traditional Name: 6-(3-methylpiperazino)-N-[3-(methylthio)phenyl]nicotinamide Formula: C18H22N4OS MolecularWeight: 342.45848

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1)C2=NC=C(C=C2)C(=O)NC3=CC(=CC=C3)SC

Isomeric SMILES

CC1CN(CCN1)C2=NC=C(C=C2)C(=O)NC3=CC(=CC=C3)SC

InChI

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