Einecs 255-415-1

(3Z)-3-[(2Z)-2-(3-ethyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)-5-methylsulfanyl-1,3,4-thiadiazol-3-ium-3-ylidene]propane-1-sulfonate;pyridine

Also Known As: EINECS 255-415-1|3-(2-(3-Ethyl-4-oxo-2-thioxothiazolidin-5-ylidene)-5-(methylthio)-1,3,4-thiadiazol-3(2H)-ylidene)propanesulphonic acid, compound with pyridine (1:1)|(3Z)-3-[(2Z)-2-(3-ethyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)-5-methylsulfanyl-1,3,4-thiadiazol-3-ium-3-ylidene]propane-1-sulfonate; pyridine|(3Z)-3-[(5Z)-5-(3-ethyl-4-oxo-2-sulfanylidene-thiazolidin-5-ylidene)-2-methylsulfanyl-1-thia-3-aza-4-azoniacyclopent-2-en-4-ylidene]propane-1-sulfonate; pyridine|3-[2-(3-ethyl-4-oxo-2-thioxothiazolidin-5-ylidene)-5-(methylthio)-1,3,4-thiadiazol-3(2H)-propanesulphonic acid, compound with pyridine (1:1)

Molecular Formula	C16H18N4O4S5
Molecular Weight	489.99316 g/mol
LogP	1.16769
Topological Polar Surface Area	109.19 Ų
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	10
Rotatable Bonds	5
Exact Mass	489.99316
Monoisotopic Mass	489.99316
Heavy Atoms	29
Complexity	1059.5503

Chemical Identifiers

CAS Number	41504-10-3
SMILES	CCN1C(=O)/C(=C/2\[N+](=C\CCS(=O)(=O)[O-])\N=C(S2)SC)/SC1=S.C1=CC=NC=C1