Vitas-M small molecule compound

methyl N-{[(4-methyl-6-phenylpyrimidin-2-yl)sulfanyl]acetyl}leucinate

Catalog ID
STK922039
SMILES COC(=O)C(NC(=O)CSc1nc(C)cc(n1)c1ccccc1)CC(C)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 C20H25N3O3S MW 387.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H25N3O3S/c1-13(2)10-17(19(25)26-4)22-18(24)12-27-20-21-14(3)11-16(23-20)15-8-6-5-7-9-15/h5-9,11,13,17H,10,12H2,1-4H3,(H,22,24)
InChIKey
ULDXLOTXFKBYTG-UHFFFAOYSA-N
Synonyms
1040924-76-2
1040924762
CC1=NC(=NC(=C1)C2=CC=CC=C2)SCC(=O)NC(CC(C)C)C(=O)OC
InChI=1SC20H25N3O3Sc113(2)1017(19(25)264)2218(24)1227202114(3)1116(2320)158657915h59111317H1012H214H3(H2224)
METHYL4METHYL2((2(4METHYL6PHENYLPYRIMIDIN2YL)SULFANYLACETYL)AMINO)PENTANOATE
methylN(((4methyl6phenylpyrimidin2yl)sulfanyl)acetyl)leucinate
MFCD02609062
ZINC000002797387
ZINC000002797388

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Available files

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