1-[4-[[[5-(4-methylsulfonylphenyl)pyridin-2-yl]amino]methyl]piperidin-1-yl]pentan-1-one

Systemtic Name: 1-[4-[[[5-(4-methylsulfonylphenyl)pyridin-2-yl]amino]methyl]piperidin-1-yl]pentan-1-one Openeye Name: 1-[4-[[[5-(4-methylsulfonylphenyl)-2-pyridyl]amino]methyl]-1-piperidyl]pentan-1-one CAS Name: 1-[4-[[[5-(4-methylsulfonylphenyl)-2-pyridinyl]amino]methyl]-1-piperidinyl]-1-pentanone IUPAC Name: 1-[4-[[[5-(4-methylsulfonylphenyl)pyridin-2-yl]amino]methyl]piperidin-1-yl]pentan-1-one Traditional Name: 1-[4-[[[5-(4-mesylphenyl)-2-pyridyl]amino]methyl]piperidino]pentan-1-one Formula: C23H31N3O3S MolecularWeight: 429.57554

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)N1CCC(CC1)CNC2=NC=C(C=C2)C3=CC=C(C=C3)S(=O)(=O)C

Isomeric SMILES

CCCCC(=O)N1CCC(CC1)CNC2=NC=C(C=C2)C3=CC=C(C=C3)S(=O)(=O)C

InChI

InChI=1S/C23H31N3O3S/c1-3-4-5-23(27)26-14-12-18(13-15-26)16-24-22-11-8-20(17-25-22)19-6-9-21(10-7-19)30(2,28)29/h6-11,17-18H,3-5,12-16H2,1-2H3,(H,24,25)