Vitas-M small molecule compound
(5Z)-5-{[5-(3-methyl-4-nitrophenyl)furan-2-yl]methylidene}-1-(prop-2-en-1-yl)pyrimidine-2,4,6(1H,3H,5H)-trione
Catalog ID
STL418588
SMILES C=CCN1C(=O)NC(=O)/C(=C/c2ccc(o2)c2ccc(c(c2)C)[N+](=O)[O-])/C1=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 C19H15N3O6 MW 381.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H15N3O6/c1-3-8-21-18(24)14(17(23)20-19(21)25)10-13-5-7-16(28-13)12-4-6-15(22(26)27)11(2)9-12/h3-7,9-10H,1,8H2,2H3,(H,20,23,25)/b14-10-InChIKey
KBQKLCGJJOWDGX-UVTDQMKNSA-NSynonyms
(5Z)5((5(3methyl4nitrophenyl)furan2yl)methylidene)1(prop2en1yl)pyrimidine246(1H3H5H)trione
(5Z)5((5(3METHYL4NITROPHENYL)FURAN2YL)METHYLIDENE)1PROP2ENYL13DIAZINANE246TRIONE
C=CCN1C(=O)NC(=O)C(=Cc2ccc(o2)c2ccc(c(c2)C)(N+)(=O)(O))C1=O
CC1=C(C=CC(=C1)C2=CC=C(O2)C=C3C(=O)NC(=O)N(C3=O)CC=C)(N+)(=O)(O)
InChI=1SC19H15N3O6c1382118(24)14(17(23)2019(21)25)10135716(2813)124615(22(26)27)11(2)912h37910H18H22H3(H202325)b1410
MFCD04083179
ZINC000000842752
ZINC00842752
ZINC842752
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