AC1O1MZM

4-[(5Z)-5-[[5-(4-ethoxycarbonylphenyl)furan-2-yl]methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]butanoic acid

Also Known As: 4-[(5Z)-5-({5-[4-(ethoxycarbonyl)phenyl]furan-2-yl}methylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]butanoic acid|(Z)-4-(5-((5-(4-(ethoxycarbonyl)phenyl)furan-2-yl)methylene)-4-oxo-2-thioxothiazolidin-3-yl)butanoic acid|4-[(5Z)-5-[[5-(4-ethoxycarbonylphenyl)furan-2-yl]methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]butanoic acid|4-[5-({5-[4-(ethoxycarbonyl)phenyl](2-furyl)}methylene)-4-oxo-2-thioxo-1,3-thi azolidin-3-yl]butanoic acid

Molecular Formula	C21H19NO6S2
Molecular Weight	445.06537 g/mol
LogP	4.1893
Topological Polar Surface Area	97.05 Ų
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	7
Rotatable Bonds	8
Exact Mass	445.06537
Monoisotopic Mass	445.06537
Heavy Atoms	30
Complexity	1008.75885

Chemical Identifiers

CAS Number	620574-95-0
SMILES	CCOC(=O)C1=CC=C(C=C1)C2=CC=C(O2)/C=C\3/C(=O)N(C(=S)S3)CCCC(=O)O