Vitas-M small molecule compound
(5E)-1-(3-bromophenyl)-5-[(1-ethyl-2,5-dimethyl-1H-pyrrol-3-yl)methylidene]-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Catalog ID
STK195552
SMILES CCn1c(C)cc(c1C)/C=C/1\C(=O)NC(=S)N(C1=O)c1cccc(c1)Br
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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 C19H18BrN3O2S MW 432.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H18BrN3O2S/c1-4-22-11(2)8-13(12(22)3)9-16-17(24)21-19(26)23(18(16)25)15-7-5-6-14(20)10-15/h5-10H,4H2,1-3H3,(H,21,24,26)/b16-9+InChIKey
IMLDBRWECBOTAQ-CXUHLZMHSA-NSynonyms
(5E)1(3BROMOPHENYL)5((1ETHYL25DIMETHYL1HPYRROL3YL)METHYLIDENE)2THIOXODIHYDROPYRIMIDINE46(1H5H)DIONE
(5E)1(3BROMOPHENYL)5((1ETHYL25DIMETHYLPYRROL3YL)METHYLIDENE)2SULFANYLIDENE13DIAZINANE46DIONE
CCN1C(=CC(=C1C)C=C2C(=O)NC(=S)N(C2=O)C3=CC(=CC=C3)Br)C
CCn1c(C)cc(c1C)C=C1C(=O)NC(=S)N(C1=O)c1cccc(c1)Br
InChI=1SC19H18BrN3O2Sc142211(2)813(12(22)3)91617(24)2119(26)23(18(16)25)1575614(20)1015h510H4H213H3(H212426)b169+
MFCD03994631
ZINC000001134862
ZINC01134862
ZINC1134862
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