cyclohexyl-[4-[[[5-(4-methylsulfonylphenyl)pyridin-2-yl]amino]methyl]piperidin-1-yl]methanone

Systemtic Name: cyclohexyl-[4-[[[5-(4-methylsulfonylphenyl)pyridin-2-yl]amino]methyl]piperidin-1-yl]methanone Openeye Name: cyclohexyl-[4-[[[5-(4-methylsulfonylphenyl)-2-pyridyl]amino]methyl]-1-piperidyl]methanone CAS Name: cyclohexyl-[4-[[[5-(4-methylsulfonylphenyl)-2-pyridinyl]amino]methyl]-1-piperidinyl]methanone IUPAC Name: cyclohexyl-[4-[[[5-(4-methylsulfonylphenyl)pyridin-2-yl]amino]methyl]piperidin-1-yl]methanone Traditional Name: cyclohexyl-[4-[[[5-(4-mesylphenyl)-2-pyridyl]amino]methyl]piperidino]methanone Formula: C25H33N3O3S MolecularWeight: 455.61282

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)C2=CN=C(C=C2)NCC3CCN(CC3)C(=O)C4CCCCC4

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)C2=CN=C(C=C2)NCC3CCN(CC3)C(=O)C4CCCCC4

InChI

InChI=1S/C25H33N3O3S/c1-32(30,31)23-10-7-20(8-11-23)22-9-12-24(27-18-22)26-17-19-13-15-28(16-14-19)25(29)21-5-3-2-4-6-21/h7-12,18-19,21H,2-6,13-17H2,1H3,(H,26,27)