Vitas-M small molecule compound
N-{1-[(3-chlorobenzyl)amino]-4-(methylsulfanyl)-1-oxobutan-2-yl}-3-hydroxyquinoxaline-1(2H)-carboxamide
Catalog ID
STK629140
SMILES CSCCC(C(=O)NCc1cccc(c1)Cl)NC(=O)N1CC(=Nc2c1cccc2)O
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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 C21H23ClN4O3S MW 446.96 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23ClN4O3S/c1-30-10-9-17(20(28)23-12-14-5-4-6-15(22)11-14)25-21(29)26-13-19(27)24-16-7-2-3-8-18(16)26/h2-8,11,17H,9-10,12-13H2,1H3,(H,23,28)(H,24,27)(H,25,29)InChIKey
MBZNVVBUPITQIN-UHFFFAOYSA-NSynonyms
CSCCC(C(=O)NCC1=CC(=CC=C1)Cl)NC(=O)N2CC(=O)NC3=CC=CC=C32
InChI=1SC21H23ClN4O3Sc13010917(20(28)23121454615(22)1114)2521(29)261319(27)2416723818(16)26h281117H9101213H21H3(H2328)(H2427)(H2529)
MFCD09793281
N(1((3chlorobenzyl)amino)4(methylsulfanyl)1oxobutan2yl)3hydroxyquinoxaline1(2H)carboxamide
N(1((3chlorophenyl)methylamino)4methylsulfanyl1oxobutan2yl)3oxo24dihydroquinoxaline1carboxamide
ZINC000013571435
ZINC000013624383
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