Vitas-M small molecule compound

methyl N-{[5-chloro-2-(methylsulfanyl)pyrimidin-4-yl]carbonyl}methioninate

Catalog ID
STL218436
SMILES CSCCC(C(=O)OC)NC(=O)c1nc(SC)ncc1Cl

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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 C12H16ClN3O3S2 MW 349.86 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H16ClN3O3S2/c1-19-11(18)8(4-5-20-2)15-10(17)9-7(13)6-14-12(16-9)21-3/h6,8H,4-5H2,1-3H3,(H,15,17)
InChIKey
DEGPTJMQJGYQQE-UHFFFAOYSA-N
Synonyms

COC(=O)C(CCSC)NC(=O)C1=NC(=NC=C1Cl)SC
InChI=1SC12H16ClN3O3S2c11911(18)8(45202)1510(17)97(13)61412(169)213h68H45H213H3(H1517)
methyl2((5chloro2methylsulfanylpyrimidine4carbonyl)amino)4methylsulfanylbutanoate
METHYL2((5CHLORO2METHYLTHIOPYRIMIDIN4YL)CARBONYLAMINO)4METHYLTHIOBUTANOATE
methylN((5chloro2(methylsulfanyl)pyrimidin4yl)carbonyl)methioninate
MFCD18081523
ZINC000041156646
ZINC000041156649

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Available files

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