Identification
Name |
Methapyrilene Fumarate |
Synonyms |
But-2-Enedioic Acid; N',N'-Dimethyl-N-(2-Pyridyl)-N-(2-Thienylmethyl)Ethane-1,2-Diamine; N',N'-Dimethyl-N-(2-Pyridyl)-N-(2-Thienylmethyl)Ethane-1,2-Diamine; But-2-Enedioic Acid; 2-Dimethylaminoethyl-(2-Pyridyl)-(2-Thenyl)Amine; 2-Dimethylaminoethyl-(2-Pyridyl)-(2-Thienylmethyl)Amine |
|
Molecular Structure |
 |
Molecular Formula |
C40H50N6O12S2 |
Molecular Weight |
870.99 |
CAS Registry Number |
33032-12-1 |
EINECS |
251-351-3 |
SMILES |
C1=CC=CN=C1N(CC2=CC=CS2)CCN(C)C.C3=CC=CN=C3N(CC4=CC=CS4)CCN(C)C.O=C(O)\C=C\C(=O)O.O=C(O)\C=C\C(=O)O.O=C(O)\C=C\C(=O)O |
InChI |
1S/2C14H19N3S.3C4H4O4/c2*1-16(2)9-10-17(12-13-6-5-11-18-13)14-7-3-4-8-15-14;3*5-3(6)1-2-4(7)8/h2*3-8,11H,9-10,12H2,1-2H3;3*1-2H,(H,5,6)(H,7,8)/b;;3*2-1+ |
InChIKey |
OLGIEIJNOQGBSS-VQYXCCSOSA-N |
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