tert-butyl N-[2-oxidanylidene-2-[2-(4-oxidanylidene-1-piperidin-4-yl-2-pyridin-3-ylcarbonyl-butyl)sulfanylethylamino]ethyl]carbamate

Systemtic Name: tert-butyl N-[2-oxidanylidene-2-[2-(4-oxidanylidene-1-piperidin-4-yl-2-pyridin-3-ylcarbonyl-butyl)sulfanylethylamino]ethyl]carbamate Openeye Name: tert-butyl N-[2-oxo-2-[2-[4-oxo-1-(4-piperidyl)-2-(pyridine-3-carbonyl)butyl]sulfanylethylamino]ethyl]carbamate CAS Name: N-[2-oxo-2-[2-[[4-oxo-2-[oxo(3-pyridinyl)methyl]-1-(4-piperidinyl)butyl]thio]ethylamino]ethyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[2-oxo-2-[2-[4-oxo-1-piperidin-4-yl-2-(pyridine-3-carbonyl)butyl]sulfanylethylamino]ethyl]carbamate Traditional Name: N-[2-keto-2-[2-[[4-keto-2-nicotinoyl-1-(4-piperidyl)butyl]thio]ethylamino]ethyl]carbamic acid tert-butyl ester Formula: C24H36N4O5S MolecularWeight: 492.63144

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCC(=O)NCCSC(C1CCNCC1)C(CC=O)C(=O)C2=CN=CC=C2

Isomeric SMILES

CC(C)(C)OC(=O)NCC(=O)NCCSC(C1CCNCC1)C(CC=O)C(=O)C2=CN=CC=C2

InChI

InChI=1S/C24H36N4O5S/c1-24(2,3)33-23(32)28-16-20(30)27-12-14-34-22(17-6-10-25-11-7-17)19(8-13-29)21(31)18-5-4-9-26-15-18/h4-5,9,13,15,17,19,22,25H,6-8,10-12,14,16H2,1-3H3,(H,27,30)(H,28,32)