3-[1-[(1-methylsulfonylpiperidin-4-yl)amino]ethyl]benzenecarbonitrile

Systemtic Name: 3-[1-[(1-methylsulfonylpiperidin-4-yl)amino]ethyl]benzenecarbonitrile Openeye Name: 3-[1-[(1-methylsulfonyl-4-piperidyl)amino]ethyl]benzonitrile CAS Name: 3-[1-[(1-methylsulfonyl-4-piperidinyl)amino]ethyl]benzonitrile IUPAC Name: 3-[1-[(1-methylsulfonylpiperidin-4-yl)amino]ethyl]benzonitrile Traditional Name: 3-[1-[(1-mesyl-4-piperidyl)amino]ethyl]benzonitrile Formula: C15H21N3O2S MolecularWeight: 307.41114

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC(=C1)C#N)NC2CCN(CC2)S(=O)(=O)C

Isomeric SMILES

CC(C1=CC=CC(=C1)C#N)NC2CCN(CC2)S(=O)(=O)C

InChI

InChI=1S/C15H21N3O2S/c1-12(14-5-3-4-13(10-14)11-16)17-15-6-8-18(9-7-15)21(2,19)20/h3-5,10,12,15,17H,6-9H2,1-2H3