5-[4-(phenylmethyl)piperidin-1-yl]sulfonyl-N-(2-quinolin-8-ylethyl)pyridin-2-amine

Systemtic Name: 5-[4-(phenylmethyl)piperidin-1-yl]sulfonyl-N-(2-quinolin-8-ylethyl)pyridin-2-amine Openeye Name: 5-[(4-benzyl-1-piperidyl)sulfonyl]-N-[2-(8-quinolyl)ethyl]pyridin-2-amine CAS Name: 5-[[4-(phenylmethyl)-1-piperidinyl]sulfonyl]-N-[2-(8-quinolinyl)ethyl]-2-pyridinamine IUPAC Name: 5-(4-benzylpiperidin-1-yl)sulfonyl-N-(2-quinolin-8-ylethyl)pyridin-2-amine Traditional Name: [5-(4-benzylpiperidino)sulfonyl-2-pyridyl]-[2-(8-quinolyl)ethyl]amine Formula: C28H30N4O2S MolecularWeight: 486.6284

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CC2=CC=CC=C2)S(=O)(=O)C3=CN=C(C=C3)NCCC4=CC=CC5=C4N=CC=C5

Isomeric SMILES

C1CN(CCC1CC2=CC=CC=C2)S(=O)(=O)C3=CN=C(C=C3)NCCC4=CC=CC5=C4N=CC=C5

InChI

InChI=1S/C28H30N4O2S/c33-35(34,32-18-14-23(15-19-32)20-22-6-2-1-3-7-22)26-11-12-27(31-21-26)29-17-13-25-9-4-8-24-10-5-16-30-28(24)25/h1-12,16,21,23H,13-15,17-20H2,(H,29,31)