Vitas-M small molecule compound
(5E)-5-[(3-methylthiophen-2-yl)methylidene]-1-(prop-2-en-1-yl)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Catalog ID
STK187294
SMILES C=CCN1C(=S)NC(=O)/C(=C\c2sccc2C)/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 C13H12N2O2S2 MW 292.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H12N2O2S2/c1-3-5-15-12(17)9(11(16)14-13(15)18)7-10-8(2)4-6-19-10/h3-4,6-7H,1,5H2,2H3,(H,14,16,18)/b9-7+InChIKey
LDBCHCVBIBATEK-VQHVLOKHSA-NSynonyms
(5E)5((3METHYLTHIOPHEN2YL)METHYLIDENE)1(PROP2EN1YL)2THIOXODIHYDROPYRIMIDINE46(1H5H)DIONE
(5E)5((3METHYLTHIOPHEN2YL)METHYLIDENE)1PROP2ENYL2SULFANYLIDENE13DIAZINANE46DIONE
C=CCN1C(=S)NC(=O)C(=Cc2sccc2C)C1=O
CC1=C(SC=C1)C=C2C(=O)NC(=S)N(C2=O)CC=C
InChI=1SC13H12N2O2S2c1351512(17)9(11(16)1413(15)18)7108(2)461910h3467H15H22H3(H141618)b97+
MFCD03237216
ZINC000004723760
ZINC04723760
ZINC4723760
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