AC1NRCSH

ethyl 1-[5-cyano-3-[(3-dodecyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-1-ethyl-4-methyl-6-oxo-2-pyridinyl]piperidine-4-carboxylate

Also Known As: Ethyl 1-{5-cyano-3-[(3-dodecyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-1-ethyl-4-methyl-6-oxo-1,6-dihydropyridin-2-yl}piperidine-4-carboxylate|ethyl 1-[5-cyano-3-[(3-dodecyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-1-ethyl-4-methyl-6-oxopyridin-2-yl]piperidine-4-carboxylate

Molecular Formula	C33H48N4O4S2
Molecular Weight	628.3117 g/mol
LogP	6.9499
Topological Polar Surface Area	95.64 Ų
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	8
Rotatable Bonds	16
Exact Mass	628.3117
Monoisotopic Mass	628.3117
Heavy Atoms	43
Complexity	1274.9155

Chemical Identifiers

CAS Number	7063-81-2
SMILES	CCCCCCCCCCCCN1C(=O)C(=CC2=C(N(C(=O)C(=C2C)C#N)CC)N3CCC(CC3)C(=O)OCC)SC1=S