AC1NZOGH

5-(1,3-benzodioxol-5-ylmethyliminomethyl)-1-butyl-6-hydroxy-2-sulfanylidenepyrimidin-4-one

Also Known As: (5E)-5-[(1,3-benzodioxol-5-ylmethylamino)methylidene]-1-butyl-2-sulfanylidene-1,3-diazinane-4,6-dione|(5Z)-5-[(1,3-benzodioxol-5-ylmethylamino)methylidene]-1-butyl-2-sulfanylidene-1,3-diazinane-4,6-dione|(5Z)-5-{[(1,3-benzodioxol-5-ylmethyl)amino]methylidene}-1-butyl-2-sulfanylpyrimidine-4,6(1H,5H)-dione|(E)-5-(((benzo[d][1,3]dioxol-5-ylmethyl)amino)methylene)-1-butyl-2-thioxodihydropyrimidine-4,6(1H,5H)-dione|5-[(1,3-benzodioxol-5-ylmethylamino)methylidene]-1-butyl-2-sulfanylidene-1,3-diazinane-4,6-dione|5-[(benzo[1,3]dioxol-5-ylmethylamino)methylidene]-1-butyl-2-sulfanylidene-1,3-diazinane-4,6-dione

Molecular Formula	C17H19N3O4S
Molecular Weight	361.10962 g/mol
LogP	2.75939
Topological Polar Surface Area	88.84 Ų
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	6
Rotatable Bonds	6
Exact Mass	361.10962
Monoisotopic Mass	361.10962
Heavy Atoms	25
Complexity	917.0846

Chemical Identifiers

CAS Number	577986-17-5
SMILES	CCCCN1C(=C(C(=O)NC1=S)C=NCC2=CC3=C(C=C2)OCO3)O