AC1LPUSW

methyl 2-[(5E)-5-[[1-(1,3-benzodioxol-5-yl)-2,5-dimethylpyrrol-3-yl]methylidene]-2,4-dioxo-1,3-thiazolidin-3-yl]acetate

Also Known As: methyl [(5E)-5-{[1-(1,3-benzodioxol-5-yl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-2,4-dioxo-1,3-thiazolidin-3-yl]acetate|(E)-methyl 2-(5-((1-(benzo[d][1,3]dioxol-5-yl)-2,5-dimethyl-1H-pyrrol-3-yl)methylene)-2,4-dioxothiazolidin-3-yl)acetate|methyl 2-[(5E)-5-[[1-(1,3-benzodioxol-5-yl)-2,5-dimethylpyrrol-3-yl]methylidene]-2,4-dioxo-1,3-thiazolidin-3-yl]acetate

Molecular Formula	C20H18N2O6S
Molecular Weight	414.08856 g/mol
LogP	3.03214
Topological Polar Surface Area	87.07 Ų
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	7
Rotatable Bonds	4
Exact Mass	414.08856
Monoisotopic Mass	414.08856
Heavy Atoms	29
Complexity	1071.164

Chemical Identifiers

CAS Number	677754-05-1
SMILES	CC1=CC(=C(N1C2=CC3=C(C=C2)OCO3)C)/C=C/4\C(=O)N(C(=O)S4)CC(=O)OC