N-(4-methylsulfanylphenyl)-1-pyrazin-2-yl-piperidine-4-carboxamide

Systemtic Name: N-(4-methylsulfanylphenyl)-1-pyrazin-2-yl-piperidine-4-carboxamide Openeye Name: N-(4-methylsulfanylphenyl)-1-pyrazin-2-yl-piperidine-4-carboxamide CAS Name: N-[4-(methylthio)phenyl]-1-(2-pyrazinyl)-4-piperidinecarboxamide IUPAC Name: N-(4-methylsulfanylphenyl)-1-pyrazin-2-ylpiperidine-4-carboxamide Traditional Name: N-[4-(methylthio)phenyl]-1-pyrazin-2-yl-isonipecotamide Formula: C17H20N4OS MolecularWeight: 328.4319

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)NC(=O)C2CCN(CC2)C3=NC=CN=C3

Isomeric SMILES

CSC1=CC=C(C=C1)NC(=O)C2CCN(CC2)C3=NC=CN=C3

InChI

InChI=1S/C17H20N4OS/c1-23-15-4-2-14(3-5-15)20-17(22)13-6-10-21(11-7-13)16-12-18-8-9-19-16/h2-5,8-9,12-13H,6-7,10-11H2,1H3,(H,20,22)