Vitas-M small molecule compound

5-{2-[(3-chlorobenzyl)oxy]-3-methoxybenzylidene}-2-thioxodihydropyrimidine-4,6(1H,5H)-dione

Catalog ID
STL383441
SMILES COc1cccc(c1OCc1cccc(c1)Cl)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 C19H15ClN2O4S MW 402.86 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H15ClN2O4S/c1-25-15-7-3-5-12(9-14-17(23)21-19(27)22-18(14)24)16(15)26-10-11-4-2-6-13(20)8-11/h2-9H,10H2,1H3,(H2,21,22,23,24,27)
InChIKey
LCUPJECXXCLKOX-UHFFFAOYSA-N
Synonyms
494757-54-9
494757549
5((2((3CHLOROPHENYL)METHOXY)3METHOXYPHENYL)METHYLIDENE)2SULFANYLIDENE13DIAZINANE46DIONE
5(2((3chlorobenzyl)oxy)3methoxybenzylidene)2thioxodihydropyrimidine46(1H5H)dione
COC1=CC=CC(=C1OCC2=CC(=CC=C2)Cl)C=C3C(=O)NC(=S)NC3=O
InChI=1SC19H15ClN2O4Sc1251573512(91417(23)2119(27)2218(14)24)16(15)26101142613(20)811h29H10H21H3(H22122232427)
MFCD02604557
ZINC000000979583
ZINC00979583
ZINC979583

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Available files

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