Vitas-M small molecule compound
(5Z)-5-{1-[(1,3-benzodioxol-5-ylmethyl)amino]ethylidene}-6-hydroxy-3-(prop-2-en-1-yl)pyrimidine-2,4(3H,5H)-dione
Catalog ID
STL040482
SMILES C=CCN1C(=O)N=C(/C(=C(/NCc2ccc3c(c2)OCO3)\C)/C1=O)O
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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 C17H17N3O5 MW 343.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H17N3O5/c1-3-6-20-16(22)14(15(21)19-17(20)23)10(2)18-8-11-4-5-12-13(7-11)25-9-24-12/h3-5,7,18H,1,6,8-9H2,2H3,(H,19,21,23)/b14-10-InChIKey
JDMLLDCIHDNPPU-UVTDQMKNSA-NSynonyms
(5Z)5(1((13benzodioxol5ylmethyl)amino)ethylidene)6hydroxy3(prop2en1yl)pyrimidine24(3H5H)dione
(5Z)5(1(13BENZODIOXOL5YLMETHYLAMINO)ETHYLIDENE)1PROP2ENYL13DIAZINANE246TRIONE
C=CCN1C(=O)N=C(C(=C(NCc2ccc3c(c2)OCO3)C)C1=O)O
CC(=C1C(=O)NC(=O)N(C1=O)CC=C)NCC2=CC3=C(C=C2)OCO3
InChI=1SC17H17N3O5c1362016(22)14(15(21)1917(20)23)10(2)18811451213(711)2592412h35718H1689H22H3(H192123)b1410
MFCD05729947
ZINC000005816537
ZINC5816537
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