Vitas-M small molecule compound
5-{4-[2-(3-methoxyphenoxy)ethoxy]benzylidene}-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Catalog ID
STK021046
SMILES COc1cccc(c1)OCCOc1ccc(cc1)C=C1C(=O)NC(=S)NC1=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 C20H18N2O5S MW 398.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18N2O5S/c1-25-15-3-2-4-16(12-15)27-10-9-26-14-7-5-13(6-8-14)11-17-18(23)21-20(28)22-19(17)24/h2-8,11-12H,9-10H2,1H3,(H2,21,22,23,24,28)InChIKey
RASLQGWGNFOSGB-UHFFFAOYSA-NSynonyms
5((4(2(3METHOXYPHENOXY)ETHOXY)PHENYL)METHYLIDENE)2SULFANYLIDENE13DIAZINANE46DIONE
5(4(2(3METHOXYPHENOXY)ETHOXY)BENZYLIDENE)2THIOXODIHYDROPYRIMIDINE46(1H5H)DIONE
COC1=CC(=CC=C1)OCCOC2=CC=C(C=C2)C=C3C(=O)NC(=S)NC3=O
COc1cccc(c1)OCCOc1ccc(cc1)C=C1C(=O)NC(=S)NC1=O
InChI=1SC20H18N2O5Sc1251532416(1215)2710926147513(6814)111718(23)2120(28)2219(17)24h281112H910H21H3(H22122232428)
MFCD02126025
STK021046
ZINC000004590339
ZINC04590339
ZINC4590339
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