Vitas-M small molecule compound
ethyl 2-{[(4-iodo-1-methyl-1H-pyrazol-5-yl)carbonyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STL399142
SMILES CCOC(=O)c1c(sc2c1CCCC2)NC(=O)c1c(I)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 C16H18IN3O3S MW 459.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H18IN3O3S/c1-3-23-16(22)12-9-6-4-5-7-11(9)24-15(12)19-14(21)13-10(17)8-18-20(13)2/h8H,3-7H2,1-2H3,(H,19,21)InChIKey
DRRCFZAGRRKYKS-UHFFFAOYSA-NSynonyms
491831-30-2491831302
CCOC(=O)C1=C(SC2=C1CCCC2)NC(=O)C3=C(C=NN3C)I
ethyl2(((4iodo1methyl1Hpyrazol5yl)carbonyl)amino)4567tetrahydro1benzothiophene3carboxylate
ethyl2((4iodo2methylpyrazole3carbonyl)amino)4567tetrahydro1benzothiophene3carboxylate
InChI=1SC16H18IN3O3Sc132316(22)129645711(9)2415(12)1914(21)1310(17)81820(13)2h8H37H212H3(H1921)
MFCD01244168
ZINC000002766398
ZINC02766398
ZINC2766398
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