Vitas-M small molecule compound
ethyl 2-{[(4-bromo-1-methyl-1H-pyrazol-5-yl)carbonyl]amino}-5-(diethylcarbamoyl)-4-methylthiophene-3-carboxylate
Catalog ID
STK957719
SMILES CCOC(=O)c1c(sc(c1C)C(=O)N(CC)CC)NC(=O)c1c(Br)cnn1C
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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 C18H23BrN4O4S MW 471.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H23BrN4O4S/c1-6-23(7-2)17(25)14-10(4)12(18(26)27-8-3)16(28-14)21-15(24)13-11(19)9-20-22(13)5/h9H,6-8H2,1-5H3,(H,21,24)InChIKey
NDFJFNMYJLEFGK-UHFFFAOYSA-NSynonyms
491832-16-7491832167
CCN(CC)C(=O)C1=C(C(=C(S1)NC(=O)C2=C(C=NN2C)Br)C(=O)OCC)C
ETHYL2(((4BROMO1METHYL1HPYRAZOL5YL)CARBONYL)AMINO)5((DIETHYLAMINO)CARBONYL)4METHYL3THIOPHENECARBOXYLATE
ethyl2(((4bromo1methyl1Hpyrazol5yl)carbonyl)amino)5(diethylcarbamoyl)4methylthiophene3carboxylate
ETHYL2((4BROMO2METHYLPYRAZOLE3CARBONYL)AMINO)5(DIETHYLCARBAMOYL)4METHYLTHIOPHENE3CARBOXYLATE
InChI=1SC18H23BrN4O4Sc1623(72)17(25)1410(4)12(18(26)2783)16(2814)2115(24)1311(19)92022(13)5h9H68H215H3(H2124)
MFCD01919452
ZINC000000689387
ZINC00689387
ZINC689387
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