Vitas-M small molecule compound

5-(3-chloro-4-hydroxybenzylidene)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione

Catalog ID
STK187095
SMILES S=C1NC(=O)C(=Cc2ccc(c(c2)Cl)O)C(=O)N1

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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 C11H7ClN2O3S MW 282.71 g/mol Purity >90% as per NMR
InChI
InChI=1S/C11H7ClN2O3S/c12-7-4-5(1-2-8(7)15)3-6-9(16)13-11(18)14-10(6)17/h1-4,15H,(H2,13,14,16,17,18)
InChIKey
HVLJHVXFTFHSDY-UHFFFAOYSA-N
Synonyms

5((3CHLORO4HYDROXYPHENYL)METHYLIDENE)2SULFANYLIDENE13DIAZINANE46DIONE
5(3CHLORO4HYDROXYBENZYLIDENE)2THIOXODIHYDROPYRIMIDINE46(1H5H)DIONE
C1=CC(=C(C=C1C=C2C(=O)NC(=S)NC2=O)Cl)O
InChI=1SC11H7ClN2O3Sc12745(128(7)15)369(16)1311(18)1410(6)17h1415H(H21314161718)
MFCD02379637
ZINC000000443961
ZINC00443961
ZINC443961

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Available files

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