Vitas-M small molecule compound
methyl 4-ethyl-2-{[(6-fluoro-2-methyl-3,4-dihydroquinolin-1(2H)-yl)carbonothioyl]amino}-5-methylthiophene-3-carboxylate
Catalog ID
STK436705
SMILES COC(=O)c1c(NC(=S)N2C(C)CCc3c2ccc(c3)F)sc(c1CC)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 C20H23FN2O2S2 MW 406.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H23FN2O2S2/c1-5-15-12(3)27-18(17(15)19(24)25-4)22-20(26)23-11(2)6-7-13-10-14(21)8-9-16(13)23/h8-11H,5-7H2,1-4H3,(H,22,26)InChIKey
OVCNJKNGEYMGNJ-UHFFFAOYSA-NSynonyms
CCC1=C(SC(=C1C(=O)OC)NC(=S)N2C(CCC3=C2C=CC(=C3)F)C)C
InChI=1SC20H23FN2O2S2c151512(3)2718(17(15)19(24)254)2220(26)2311(2)67131014(21)8916(13)23h811H57H214H3(H2226)
methyl4ethyl2(((6fluoro2methyl34dihydroquinolin1(2H)yl)carbonothioyl)amino)5methylthiophene3carboxylate
METHYL4ETHYL2((6FLUORO2METHYL34DIHYDRO2HQUINOLINE1CARBOTHIOYL)AMINO)5METHYLTHIOPHENE3CARBOXYLATE
MFCD03945125
ZINC000005950056
ZINC000005950057
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