Vitas-M small molecule compound
(5Z)-5-{[(1,3-benzodioxol-5-ylmethyl)amino]methylidene}-6-hydroxy-3-(2-phenylethyl)pyrimidine-2,4(3H,5H)-dione
Catalog ID
STK570750
SMILES O=C1N=C(O)/C(=C/NCc2ccc3c(c2)OCO3)/C(=O)N1CCc1ccccc1
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C21H19N3O5 MW 393.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19N3O5/c25-19-16(12-22-11-15-6-7-17-18(10-15)29-13-28-17)20(26)24(21(27)23-19)9-8-14-4-2-1-3-5-14/h1-7,10,12,22H,8-9,11,13H2,(H,23,25,27)/b16-12-InChIKey
FCEFSKURTWKMSA-VBKFSLOCSA-NSynonyms
(5Z)5(((13benzodioxol5ylmethyl)amino)methylidene)6hydroxy3(2phenylethyl)pyrimidine24(3H5H)dione
(5Z)5((13benzodioxol5ylmethylamino)methylidene)1(2phenylethyl)13diazinane246trione
(5Z)5((13BENZODIOXOL5YLMETHYLAMINO)METHYLIDENE)1PHENETHYL13DIAZINANE246TRIONE
C1OC2=C(O1)C=C(C=C2)CNC=C3C(=O)NC(=O)N(C3=O)CCC4=CC=CC=C4
InChI=1SC21H19N3O5c251916(12221115671718(1015)29132817)20(26)24(21(27)2319)98144213514h17101222H891113H2(H232527)b1612
MFCD05737682
O=C1N=C(O)C(=CNCc2ccc3c(c2)OCO3)C(=O)N1CCc1ccccc1
ZINC000005768849
ZINC5768849
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