Vitas-M small molecule compound

5,5'-[(3-fluorophenyl)methanediyl]bis(1,3-dimethyl-2-thioxodihydropyrimidine-4,6(1H,5H)-dione)

Catalog ID
STK187352
SMILES Fc1cccc(c1)C(C1C(=O)N(C)C(=S)N(C1=O)C)C1C(=O)N(C)C(=S)N(C1=O)C

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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 C19H19FN4O4S2 MW 450.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H19FN4O4S2/c1-21-14(25)12(15(26)22(2)18(21)29)11(9-6-5-7-10(20)8-9)13-16(27)23(3)19(30)24(4)17(13)28/h5-8,11-13H,1-4H3
InChIKey
LMDPCCVSNBQGNI-UHFFFAOYSA-N
Synonyms

5((13DIMETHYL46DIOXO2SULFANYLIDENE13DIAZINAN5YL)(3FLUOROPHENYL)METHYL)13DIMETHYL2SULFANYLIDENE13DIAZINANE46DIONE
5((13DIMETHYL46DIOXO2THIOXO(135TRIHYDROPYRIMIDIN5YL))(3FLUOROPHENYL)METHYL)13DIMETHYL2THIOXO135TRIHYDROPYRIMIDINE46DIONE
55((3FLUOROPHENYL)METHANEDIYL)BIS(13DIMETHYL2THIOXODIHYDROPYRIMIDINE46(1H5H)DIONE)
CN1C(=O)C(C(=O)N(C1=S)C)C(C2C(=O)N(C(=S)N(C2=O)C)C)C3=CC(=CC=C3)F
InChI=1SC19H19FN4O4S2c12114(25)12(15(26)22(2)18(21)29)11(965710(20)89)1316(27)23(3)19(30)24(4)17(13)28h581113H14H3
MFCD03167278
ZINC000001146889
ZINC01146889
ZINC1146889

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.