Vitas-M small molecule compound
(5E)-1-(3-chloro-4-methylphenyl)-5-[(2E)-3-phenylprop-2-en-1-ylidene]pyrimidine-2,4,6(1H,3H,5H)-trione
Catalog ID
STK171046
SMILES O=C1NC(=O)N(C(=O)/C/1=C/C=C/c1ccccc1)c1ccc(c(c1)Cl)C
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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 C20H15ClN2O3 MW 366.80 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H15ClN2O3/c1-13-10-11-15(12-17(13)21)23-19(25)16(18(24)22-20(23)26)9-5-8-14-6-3-2-4-7-14/h2-12H,1H3,(H,22,24,26)/b8-5+,16-9+InChIKey
PCFVJWZLYSNAGT-ZCPHBQKFSA-NSynonyms
(5E)1(3CHLORO4METHYLPHENYL)5((2E)3PHENYLPROP2EN1YLIDENE)PYRIMIDINE246(1H3H5H)TRIONE
(5E)1(3CHLORO4METHYLPHENYL)5((E)3PHENYLPROP2ENYLIDENE)13DIAZINANE246TRIONE
CC1=C(C=C(C=C1)N2C(=O)C(=CC=CC3=CC=CC=C3)C(=O)NC2=O)Cl
InChI=1SC20H15ClN2O3c113101115(1217(13)21)2319(25)16(18(24)2220(23)26)958146324714h212H1H3(H222426)b85+169+
MFCD04555204
O=C1NC(=O)N(C(=O)C1=CC=Cc1ccccc1)c1ccc(c(c1)Cl)C
ZINC000001163178
ZINC01163178
ZINC1163178
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