Vitas-M small molecule compound

(5E)-5-[(5-chlorothiophen-2-yl)methylidene]-1-(2-ethylphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione

Catalog ID
STK177933
SMILES CCc1ccccc1N1C(=O)NC(=O)/C(=C\c2ccc(s2)Cl)/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 C17H13ClN2O3S MW 360.82 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H13ClN2O3S/c1-2-10-5-3-4-6-13(10)20-16(22)12(15(21)19-17(20)23)9-11-7-8-14(18)24-11/h3-9H,2H2,1H3,(H,19,21,23)/b12-9+
InChIKey
ZOEAOSGDDYWPJO-FMIVXFBMSA-N
Synonyms

(5E)5((5CHLOROTHIOPHEN2YL)METHYLIDENE)1(2ETHYLPHENYL)13DIAZINANE246TRIONE
(5E)5((5CHLOROTHIOPHEN2YL)METHYLIDENE)1(2ETHYLPHENYL)PYRIMIDINE246(1H3H5H)TRIONE
CCC1=CC=CC=C1N2C(=O)C(=CC3=CC=C(S3)Cl)C(=O)NC2=O
CCc1ccccc1N1C(=O)NC(=O)C(=Cc2ccc(s2)Cl)C1=O
InChI=1SC17H13ClN2O3Sc1210534613(10)2016(22)12(15(21)1917(20)23)9117814(18)2411h39H2H21H3(H192123)b129+
MFCD02954763
ZINC000000634927
ZINC00634927
ZINC634927

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Available files

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