2-[10-(2-pyridin-3-ylcarbonyloxyethylsulfanyl)decylsulfanyl]ethyl pyridine-3-carboxylate

Systemtic Name: 2-[10-(2-pyridin-3-ylcarbonyloxyethylsulfanyl)decylsulfanyl]ethyl pyridine-3-carboxylate Openeye Name: 2-[10-[2-(pyridine-3-carbonyloxy)ethylsulfanyl]decylsulfanyl]ethyl pyridine-3-carboxylate CAS Name: 3-pyridinecarboxylic acid 2-[10-[2-[oxo(3-pyridinyl)methoxy]ethylthio]decylthio]ethyl ester IUPAC Name: 2-[10-[2-(pyridine-3-carbonyloxy)ethylsulfanyl]decylsulfanyl]ethyl pyridine-3-carboxylate Traditional Name: nicotinic acid 2-[10-(2-nicotinoyloxyethylthio)decylthio]ethyl ester Formula: C26H36N2O4S2 MolecularWeight: 504.70504

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)C(=O)OCCSCCCCCCCCCCSCCOC(=O)C2=CN=CC=C2

Isomeric SMILES

C1=CC(=CN=C1)C(=O)OCCSCCCCCCCCCCSCCOC(=O)C2=CN=CC=C2

InChI

InChI=1S/C26H36N2O4S2/c29-25(23-11-9-13-27-21-23)31-15-19-33-17-7-5-3-1-2-4-6-8-18-34-20-16-32-26(30)24-12-10-14-28-22-24/h9-14,21-22H,1-8,15-20H2