Vitas-M small molecule compound
ethyl 2-[{[3-(difluoromethyl)-5,6-dihydrocyclopenta[c]pyrazol-1(4H)-yl]acetyl}(prop-2-en-1-yl)amino]-4-methyl-1,3-thiazole-5-carboxylate
Catalog ID
STL393324
SMILES C=CCN(C(=O)Cn1nc(c2c1CCC2)C(F)F)c1nc(c(s1)C(=O)OCC)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 C19H22F2N4O3S MW 424.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H22F2N4O3S/c1-4-9-24(19-22-11(3)16(29-19)18(27)28-5-2)14(26)10-25-13-8-6-7-12(13)15(23-25)17(20)21/h4,17H,1,5-10H2,2-3H3InChIKey
KNIYWTKLLYGTOJ-UHFFFAOYSA-NSynonyms
938001-45-7938001457
CCOC(=O)C1=C(N=C(S1)N(CC=C)C(=O)CN2C3=C(CCC3)C(=N2)C(F)F)C
ETHYL2(((3(DIFLUOROMETHYL)56DIHYDROCYCLOPENTA(C)PYRAZOL1(4H)YL)ACETYL)(PROP2EN1YL)AMINO)4METHYL13THIAZOLE5CARBOXYLATE
ethyl2((2(3(difluoromethyl)56dihydro4Hcyclopenta(c)pyrazol1yl)acetyl)prop2enylamino)4methyl13thiazole5carboxylate
InChI=1SC19H22F2N4O3Sc14924(192211(3)16(2919)18(27)2852)14(26)10251386712(13)15(2325)17(20)21h417H1510H223H3
MFCD08555531
ZINC000036614130
ZINC36614130
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