AC1NWR9D structure

AC1NWR9D

(4E)-4-[hydroxy-(4-propan-2-yloxyphenyl)methylidene]-1-(5-methyl-1,3,4-thiadiazol-2-yl)-5-(4-nitrophenyl)pyrrolidine-2,3-dione

Also Known As: UPCMLD0ENAT5967429:001|3-hydroxy-4-(4-isopropoxybenzoyl)-1-(5-methyl-1,3,4-thiadiazol-2-yl)-5-(4-nitrophenyl)-1H-pyrrol-2(5H)-one|(4E)-4-[hydroxy-(4-propan-2-yloxyphenyl)methylidene]-1-(5-methyl-1,3,4-thiadiazol-2-yl)-5-(4-nitrophenyl)pyrrolidine-2,3-dione|(4E)-4-{hydroxy[4-(propan-2-yloxy)phenyl]methylidene}-1-(5-methyl-1,3,4-thiadiazol-2-yl)-5-(4-nitrophenyl)pyrrolidine-2,3-dione|3-hydroxy-1-(5-methyl(1,3,4-thiadiazol-2-yl))-4-{[4-(methylethoxy)phenyl]carbo nyl}-5-(4-nitrophenyl)-3-pyrrolin-2-one|3-hydroxy-1-(5-methyl-1,3,4-thiadiazol-2-yl)-5-(4-nitrophenyl)-4-{[4-(propan-2-yloxy)phenyl]carbonyl}-1,5-dihydro-2H-pyrrol-2-one

CAS: 384367-49-1
Molecular Formula C23H20N4O6S
Molecular Weight 480.11035 g/mol
LogP 4.16822
Topological Polar Surface Area 135.76 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 9
Rotatable Bonds 6
Exact Mass 480.11035
Monoisotopic Mass 480.11035
Heavy Atoms 34
Complexity 1297.7544

Chemical Identifiers

CAS Number 384367-49-1
SMILES CC1=NN=C(S1)N2C(/C(=C(/C3=CC=C(C=C3)OC(C)C)\O)/C(=O)C2=O)C4=CC=C(C=C4)[N+](=O)[O-]

Product Overview

AC1NWR9D (CAS 384367-49-1), with molecular formula C23H20N4O6S and molecular weight 480.11035 g/mol. IUPAC: (4E)-4-[hydroxy-(4-propan-2-yloxyphenyl)methylidene]-1-(5-methyl-1,3,4-thiadiazol-2-yl)-5-(4-nitrophenyl)pyrrolidine-2,3-dione.

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