4-methylsulfonyl-N-(1-pyridin-2-ylethyl)piperazine-1-carboxamide

Systemtic Name: 4-methylsulfonyl-N-(1-pyridin-2-ylethyl)piperazine-1-carboxamide Openeye Name: 4-methylsulfonyl-N-[1-(2-pyridyl)ethyl]piperazine-1-carboxamide CAS Name: 4-methylsulfonyl-N-[1-(2-pyridinyl)ethyl]-1-piperazinecarboxamide IUPAC Name: 4-methylsulfonyl-N-(1-pyridin-2-ylethyl)piperazine-1-carboxamide Traditional Name: 4-mesyl-N-[1-(2-pyridyl)ethyl]piperazine-1-carboxamide Formula: C13H20N4O3S MolecularWeight: 312.3879

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=N1)NC(=O)N2CCN(CC2)S(=O)(=O)C

Isomeric SMILES

CC(C1=CC=CC=N1)NC(=O)N2CCN(CC2)S(=O)(=O)C

InChI

InChI=1S/C13H20N4O3S/c1-11(12-5-3-4-6-14-12)15-13(18)16-7-9-17(10-8-16)21(2,19)20/h3-6,11H,7-10H2,1-2H3,(H,15,18)