AC1NRBUO

2-[5-[(5-cyano-1-ethyl-4-methyl-6-oxo-2-piperidin-1-yl-3-pyridinyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]acetic acid

Also Known As: (5-{[5-Cyano-1-ethyl-4-methyl-6-oxo-2-(piperidin-1-yl)-1,6-dihydropyridin-3-yl]methylidene}-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl)acetic acid|2-[5-[(5-cyano-1-ethyl-4-methyl-6-oxo-2-piperidin-1-ylpyridin-3-yl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]acetic acid

Molecular Formula	C20H22N4O4S2
Molecular Weight	446.10825 g/mol
LogP	2.3244
Topological Polar Surface Area	106.64 Ų
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	7
Rotatable Bonds	5
Exact Mass	446.10825
Monoisotopic Mass	446.10825
Heavy Atoms	30
Complexity	1048.3569

Chemical Identifiers

CAS Number	7063-52-7
SMILES	CCN1C(=C(C(=C(C1=O)C#N)C)C=C2C(=O)N(C(=S)S2)CC(=O)O)N3CCCCC3