AC1NYW40

1,4-dimethyl-2-oxo-5-[(Z)-[4-oxo-3-(oxolan-2-ylmethyl)-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]-6-pyrrolidin-1-ylpyridine-3-carbonitrile

Also Known As: (Z)-1,4-dimethyl-2-oxo-5-((4-oxo-3-((tetrahydrofuran-2-yl)methyl)-2-thioxothiazolidin-5-ylidene)methyl)-6-(pyrrolidin-1-yl)-1,2-dihydropyridine-3-carbonitrile|1,4-dimethyl-2-oxo-5-[(Z)-[4-oxo-3-(oxolan-2-ylmethyl)-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]-6-pyrrolidin-1-ylpyridine-3-carbonitrile|1,4-dimethyl-2-oxo-5-{(Z)-[4-oxo-3-(tetrahydrofuran-2-ylmethyl)-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-6-(pyrrolidin-1-yl)-1,2-dihydropyridine-3-carbonitrile

Molecular Formula	C21H24N4O3S2
Molecular Weight	444.129 g/mol
LogP	2.5458
Topological Polar Surface Area	78.57 Ų
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	7
Rotatable Bonds	4
Exact Mass	444.129
Monoisotopic Mass	444.129
Heavy Atoms	30
Complexity	1028.1578

Chemical Identifiers

CAS Number	620153-95-9
SMILES	CC1=C(C(=O)N(C(=C1/C=C\2/C(=O)N(C(=S)S2)CC3CCCO3)N4CCCC4)C)C#N