(3S)-N-methyl-N-(2-pyridin-2-ylethyl)-1-quinolin-8-ylsulfonyl-piperidin-3-amine

Systemtic Name: (3S)-N-methyl-N-(2-pyridin-2-ylethyl)-1-quinolin-8-ylsulfonyl-piperidin-3-amine Openeye Name: (3S)-N-methyl-N-[2-(2-pyridyl)ethyl]-1-(8-quinolylsulfonyl)piperidin-3-amine CAS Name: (3S)-N-methyl-N-[2-(2-pyridinyl)ethyl]-1-(8-quinolinylsulfonyl)-3-piperidinamine IUPAC Name: (3S)-N-methyl-N-(2-pyridin-2-ylethyl)-1-quinolin-8-ylsulfonylpiperidin-3-amine Traditional Name: methyl-[2-(2-pyridyl)ethyl]-[(3S)-1-(8-quinolylsulfonyl)-3-piperidyl]amine Formula: C22H26N4O2S MolecularWeight: 410.53244

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC1=CC=CC=N1)C2CCCN(C2)S(=O)(=O)C3=CC=CC4=C3N=CC=C4

Isomeric SMILES

CN(CCC1=CC=CC=N1)[C@H]2CCCN(C2)S(=O)(=O)C3=CC=CC4=C3N=CC=C4

InChI

InChI=1S/C22H26N4O2S/c1-25(16-12-19-9-2-3-13-23-19)20-10-6-15-26(17-20)29(27,28)21-11-4-7-18-8-5-14-24-22(18)21/h2-5,7-9,11,13-14,20H,6,10,12,15-17H2,1H3/t20-/m0/s1