Vitas-M small molecule compound
(5E)-5-{[(1,3-benzodioxol-5-ylmethyl)amino]methylidene}-3-(furan-2-ylmethyl)-6-hydroxypyrimidine-2,4(3H,5H)-dione
Catalog ID
STK589865
SMILES O=C1N=C(O)/C(=C\NCc2ccc3c(c2)OCO3)/C(=O)N1Cc1ccco1
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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 C18H15N3O6 MW 369.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H15N3O6/c22-16-13(8-19-7-11-3-4-14-15(6-11)27-10-26-14)17(23)21(18(24)20-16)9-12-2-1-5-25-12/h1-6,8,19H,7,9-10H2,(H,20,22,24)/b13-8+InChIKey
BBOYASSMMCFOSD-MDWZMJQESA-NSynonyms
(5E)5(((13benzodioxol5ylmethyl)amino)methylidene)3(furan2ylmethyl)6hydroxypyrimidine24(3H5H)dione
(5E)5((13BENZODIOXOL5YLMETHYLAMINO)METHYLIDENE)1(FURAN2YLMETHYL)13DIAZINANE246TRIONE
5(((2HBENZO(34D)13DIOXOLEN5YLMETHYL)AMINO)METHYLENE)1(2FURYLMETHYL)13DIHYDROPYRIMIDINE246TRIONE
C1OC2=C(O1)C=C(C=C2)CNC=C3C(=O)NC(=O)N(C3=O)CC4=CC=CO4
InChI=1SC18H15N3O6c221613(819711341415(611)27102614)17(23)21(18(24)2016)9122152512h16819H7910H2(H202224)b138+
MFCD07208963
O=C1N=C(O)C(=CNCc2ccc3c(c2)OCO3)C(=O)N1Cc1ccco1
ZINC000005635921
ZINC05635921
ZINC5635921
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