AC1NRG3E

5-[(3-butan-2-yl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-1-butyl-6-(4-ethylpiperazin-1-yl)-4-methyl-2-oxopyridine-3-carbonitrile

Also Known As: 5-[(3-butan-2-yl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-1-butyl-6-(4-ethylpiperazin-1-yl)-4-methyl-2-oxopyridine-3-carbonitrile|5-{[3-(Butan-2-yl)-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}-1-butyl-6-(4-ethylpiperazin-1-yl)-4-methyl-2-oxo-1,2-dihydropyridine-3-carbonitrile

Molecular Formula	C25H35N5O2S2
Molecular Weight	501.2232 g/mol
LogP	3.9701
Topological Polar Surface Area	72.58 Ų
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	7
Rotatable Bonds	8
Exact Mass	501.2232
Monoisotopic Mass	501.2232
Heavy Atoms	34
Complexity	1080.2477

Chemical Identifiers

CAS Number	7064-80-4
SMILES	CCCCN1C(=C(C(=C(C1=O)C#N)C)C=C2C(=O)N(C(=S)S2)C(C)CC)N3CCN(CC3)CC