Identification
Name |
2-[4-Methyl-3-[(2-methyl-6-oxo-1H-pyrimidin-5-yl)methyl]-1,3-thiazol-3-ium-5-yl]ethyl 2-(3,3-dimethyl-1-phenyl-2-benzofuran-1-yl)acetate |
Synonyms |
2-[4-Methyl-3-[(2-Methyl-4-Oxo-3H-Pyrimidin-5-Yl)Methyl]Thiazol-3-Ium-5-Yl]Ethyl 2-(3,3-Dimethyl-1-Phenyl-Isobenzofuran-1-Yl)Acetate; 2-(3,3-Dimethyl-1-Phenyl-1-Isobenzofuranyl)Acetic Acid 2-[4-Methyl-3-[(2-Methyl-4-Oxo-3H-Pyrimidin-5-Yl)Methyl]-5-Thiazol- |
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Molecular Structure |
![CAS#: 99447-45-7, 2-[4-Methyl-3-[(2-methyl-6-oxo-1H-pyrimidin-5-yl)methyl]-1,3-thiazol-3-ium-5-yl]ethyl 2-(3,3-dimethyl-1-phenyl-2-benzofuran-1-yl)acetate](/moreStructures/99447-45-7.gif) |
Molecular Formula |
C30H32N3O4S |
Molecular Weight |
530.66 |
CAS Registry Number |
99447-45-7 |
SMILES |
[S+]1=C[N](C(=C1CCOC(=O)CC2(OC(C3=CC=CC=C23)(C)C)C4=CC=CC=C4)C)CC5=CN=C(NC5=O)C |
InChI |
1S/C30H31N3O4S/c1-20-26(38-19-33(20)18-22-17-31-21(2)32-28(22)35)14-15-36-27(34)16-30(23-10-6-5-7-11-23)25-13-9-8-12-24(25)29(3,4)37-30/h5-13,17,19H,14-16,18H2,1-4H3/p+1 |
InChIKey |
MDZZGWZRBRWIRJ-UHFFFAOYSA-O |
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