AC1NRGUA

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

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

Molecular Formula	C31H44N4O4S2
Molecular Weight	600.2804 g/mol
LogP	6.0256
Topological Polar Surface Area	95.64 Ų
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	8
Rotatable Bonds	13
Exact Mass	600.2804
Monoisotopic Mass	600.2804
Heavy Atoms	41
Complexity	1266.0381

Chemical Identifiers

CAS Number	7065-01-2
SMILES	CCCCC(CC)CN1C(=O)C(=CC2=C(N(C(=O)C(=C2C)C#N)CCCC)N3CCCC(C3)C(=O)OCC)SC1=S