Vitas-M small molecule compound
tert-butyl [(2S)-1-{(2E)-2-[(2-chloro-7-methylquinolin-3-yl)methylidene]hydrazinyl}-4-(methylsulfanyl)-1-oxobutan-2-yl]carbamate (non-preferred name)
Catalog ID
STL041402
SMILES CSCC[C@@H](C(=O)N/N=C/c1cc2ccc(cc2nc1Cl)C)NC(=O)OC(C)(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 C21H27ClN4O3S MW 450.99 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H27ClN4O3S/c1-13-6-7-14-11-15(18(22)24-17(14)10-13)12-23-26-19(27)16(8-9-30-5)25-20(28)29-21(2,3)4/h6-7,10-12,16H,8-9H2,1-5H3,(H,25,28)(H,26,27)/b23-12+/t16-/m0/s1InChIKey
JDLBHMJRNCTQMG-PDYUXYPTSA-NSynonyms
1173673-26-1((S)1(1(2CHLORO7METHYLQUINOLIN3YL)METH(E)YLIDENEHYDRAZINOCARBONYL)3METHYLSULFANYLPROPYL)CARBAMICACIDTERTBUTYLESTER
(SE)tertbutyl(1(2((2chloro7methylquinolin3yl)methylene)hydrazinyl)4(methylthio)1oxobutan2yl)carbamate
1173673261
CC1=CC2=NC(=C(C=C2C=C1)C=NNC(=O)C(CCSC)NC(=O)OC(C)(C)C)Cl
CSCC(C@@H)(C(=O)NN=Cc1cc2ccc(cc2nc1Cl)C)NC(=O)OC(C)(C)C
InChI=1SC21H27ClN4O3Sc11367141115(18(22)2417(14)1013)12232619(27)16(89305)2520(28)2921(23)4h67101216H89H215H3(H2528)(H2627)b2312+t16m0s1
MFCD04008918
tertbutyl((2S)1((2E)2((2chloro7methylquinolin3yl)methylidene)hydrazinyl)4(methylsulfanyl)1oxobutan2yl)carbamate(nonpreferredname)
tertbutylN((2S)1((2E)2((2chloro7methylquinolin3yl)methylidene)hydrazinyl)4methylsulfanyl1oxobutan2yl)carbamate
ZINC000008773119
ZINC15974265
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.