ethyl 4-[[2-(quinolin-8-ylmethylamino)pyridin-3-yl]sulfinamoylamino]piperidine-1-carboxylate

Systemtic Name: ethyl 4-[[2-(quinolin-8-ylmethylamino)pyridin-3-yl]sulfinamoylamino]piperidine-1-carboxylate Openeye Name: ethyl 4-[[2-(8-quinolylmethylamino)-3-pyridyl]sulfinamoylamino]piperidine-1-carboxylate CAS Name: 4-[[2-(8-quinolinylmethylamino)-3-pyridinyl]sulfinamoylamino]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[[2-(quinolin-8-ylmethylamino)pyridin-3-yl]sulfinamoylamino]piperidine-1-carboxylate Traditional Name: 4-[[2-(8-quinolylmethylamino)-3-pyridyl]sulfinamoylamino]piperidine-1-carboxylic acid ethyl ester Formula: C23H28N6O3S MolecularWeight: 468.57182

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)NS(=O)NC2=C(N=CC=C2)NCC3=CC=CC4=C3N=CC=C4

Isomeric SMILES

CCOC(=O)N1CCC(CC1)NS(=O)NC2=C(N=CC=C2)NCC3=CC=CC4=C3N=CC=C4

InChI

InChI=1S/C23H28N6O3S/c1-2-32-23(30)29-14-10-19(11-15-29)27-33(31)28-20-9-5-13-25-22(20)26-16-18-7-3-6-17-8-4-12-24-21(17)18/h3-9,12-13,19,27-28H,2,10-11,14-16H2,1H3,(H,25,26)