AC1NRCKU

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

Also Known As: ethyl 1-[5-cyano-1-ethyl-4-methyl-3-[[3-(2-methylpropyl)-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]-6-oxopyridin-2-yl]piperidine-3-carboxylate|Ethyl 1-(5-cyano-1-ethyl-4-methyl-3-{[3-(2-methylpropyl)-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}-6-oxo-1,6-dihydropyridin-2-yl)piperidine-3-carboxylate|ETHYL 1-[5-CYANO-1-ETHYL-4-METHYL-3-[[3-(2-METHYLPROPYL)-4-OXO-2-SULFANYLIDENE-THIAZOLIDIN-5-YLIDENE]METHYL]-6-OXO-(PYRIDIN-2-YL)]PIPERIDINE-3-CARBOXYLATE

Molecular Formula	C25H32N4O4S2
Molecular Weight	516.1865 g/mol
LogP	3.685
Topological Polar Surface Area	95.64 Ų
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	8
Rotatable Bonds	7
Exact Mass	516.1865
Monoisotopic Mass	516.1865
Heavy Atoms	35
Complexity	1165.4688

Chemical Identifiers

CAS Number	7063-75-4
SMILES	CCN1C(=C(C(=C(C1=O)C#N)C)C=C2C(=O)N(C(=S)S2)CC(C)C)N3CCCC(C3)C(=O)OCC