Vitas-M small molecule compound
methyl N-{[3-(4-chlorophenyl)-1-methyl-1H-pyrazol-5-yl]carbonyl}methioninate
Catalog ID
STL243810
SMILES COC(=O)C(NC(=O)c1cc(nn1C)c1ccc(cc1)Cl)CCSC
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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 C17H20ClN3O3S MW 381.88 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H20ClN3O3S/c1-21-15(10-14(20-21)11-4-6-12(18)7-5-11)16(22)19-13(8-9-25-3)17(23)24-2/h4-7,10,13H,8-9H2,1-3H3,(H,19,22)InChIKey
MDXFXIPBPYBACG-UHFFFAOYSA-NSynonyms
(S)methyl2(3(4chlorophenyl)1methyl1Hpyrazole5carboxamido)4(methylthio)butanoate
CN1C(=CC(=N1)C2=CC=C(C=C2)Cl)C(=O)NC(CCSC)C(=O)OC
COC(=O)(C@@H)(NC(=O)c1cc(nn1C)c1ccc(cc1)Cl)CCSC
InChI=1SC17H20ClN3O3Sc12115(1014(2021)114612(18)7511)16(22)1913(89253)17(23)242h471013H89H213H3(H1922)
methyl2((5(4chlorophenyl)2methylpyrazole3carbonyl)amino)4methylsulfanylbutanoate
methylN((3(4chlorophenyl)1methyl1Hpyrazol5yl)carbonyl)methioninate
MFCD24859752
ZINC000072405604
ZINC000095482718
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