Vitas-M small molecule compound
methyl 5-(diethylcarbamoyl)-2-{[(6-fluoro-2-methyl-3,4-dihydroquinolin-1(2H)-yl)carbonothioyl]amino}-4-methylthiophene-3-carboxylate
Catalog ID
STK458229
SMILES CCN(C(=O)c1sc(c(c1C)C(=O)OC)NC(=S)N1C(C)CCc2c1ccc(c2)F)CC
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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 C23H28FN3O3S2 MW 477.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H28FN3O3S2/c1-6-26(7-2)21(28)19-14(4)18(22(29)30-5)20(32-19)25-23(31)27-13(3)8-9-15-12-16(24)10-11-17(15)27/h10-13H,6-9H2,1-5H3,(H,25,31)InChIKey
PQBKWWFUCXTWHP-UHFFFAOYSA-NSynonyms
CCN(CC)C(=O)C1=C(C(=C(S1)NC(=S)N2C(CCC3=C2C=CC(=C3)F)C)C(=O)OC)C
InChI=1SC23H28FN3O3S2c1626(72)21(28)1914(4)18(22(29)305)20(3219)2523(31)2713(3)89151216(24)101117(15)27h1013H69H215H3(H2531)
METHYL5(DIETHYLCARBAMOYL)2((((2R)6FLUORO2METHYL34DIHYDROQUINOLIN1(2H)YL)CARBOTHIOYL)AMINO)4METHYLTHIOPHENE3CARBOXYLATE
methyl5(diethylcarbamoyl)2(((6fluoro2methyl34dihydroquinolin1(2H)yl)carbonothioyl)amino)4methylthiophene3carboxylate
METHYL5(DIETHYLCARBAMOYL)2((6FLUORO2METHYL34DIHYDRO2HQUINOLINE1CARBOTHIOYL)AMINO)4METHYLTHIOPHENE3CARBOXYLATE
MFCD04136939
ZINC000002853351
ZINC000002853352
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