Vitas-M small molecule compound
(5Z)-5-{1-[(1,3-benzodioxol-5-ylmethyl)amino]ethylidene}-3-benzyl-6-hydroxypyrimidine-2,4(3H,5H)-dione
Catalog ID
STK579247
SMILES O=C1N=C(O)/C(=C(/NCc2ccc3c(c2)OCO3)\C)/C(=O)N1Cc1ccccc1
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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/c1-13(22-10-15-7-8-16-17(9-15)29-12-28-16)18-19(25)23-21(27)24(20(18)26)11-14-5-3-2-4-6-14/h2-9,22H,10-12H2,1H3,(H,23,25,27)/b18-13-InChIKey
ZBCSSPDYYVXIRX-AQTBWJFISA-NSynonyms
(5Z)5(1((13benzodioxol5ylmethyl)amino)ethylidene)3benzyl6hydroxypyrimidine24(3H5H)dione
(5Z)5(1(13BENZODIOXOL5YLMETHYLAMINO)ETHYLIDENE)1BENZYL13DIAZINANE246TRIONE
CC(=C1C(=O)NC(=O)N(C1=O)CC2=CC=CC=C2)NCC3=CC4=C(C=C3)OCO4
InChI=1SC21H19N3O5c113(221015781617(915)29122816)1819(25)2321(27)24(20(18)26)11145324614h2922H1012H21H3(H232527)b1813
MFCD07201195
O=C1N=C(O)C(=C(NCc2ccc3c(c2)OCO3)C)C(=O)N1Cc1ccccc1
ZINC000020291648
ZINC20291648
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