Vitas-M small molecule compound
methyl 2-({2-[(3-ethylphenyl)amino]-2-oxoethyl}sulfanyl)-4-oxo-1,4-dihydroquinoline-3-carboxylate
Catalog ID
STL124903
SMILES COC(=O)c1c(SCC(=O)Nc2cccc(c2)CC)[nH]c2c(c1=O)cccc2
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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 C21H20N2O4S MW 396.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20N2O4S/c1-3-13-7-6-8-14(11-13)22-17(24)12-28-20-18(21(26)27-2)19(25)15-9-4-5-10-16(15)23-20/h4-11H,3,12H2,1-2H3,(H,22,24)(H,23,25)InChIKey
XYBYDATVCFKXRA-UHFFFAOYSA-NSynonyms
CCC1=CC(=CC=C1)NC(=O)CSC2=C(C(=O)C3=CC=CC=C3N2)C(=O)OC
COC(=O)c1c(SCC(=O)Nc2cccc(c2)CC)(nH)c2c(c1=O)cccc2
InChI=1SC21H20N2O4Sc131376814(1113)2217(24)12282018(21(26)272)19(25)159451016(15)2320h411H312H212H3(H2224)(H2325)
methyl2((2((3ethylphenyl)amino)2oxoethyl)sulfanyl)4oxo14dihydroquinoline3carboxylate
methyl2(2(3ethylanilino)2oxoethyl)sulfanyl4oxo1Hquinoline3carboxylate
MFCD14977874
ZINC000020981941
ZINC20981941
Check stock
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