Vitas-M small molecule compound
ethyl 2-{[(2E)-3-(1,5-dimethyl-1H-pyrazol-4-yl)prop-2-enoyl](tetrahydrofuran-2-ylmethyl)amino}-4-methyl-1,3-thiazole-5-carboxylate
Catalog ID
STK315144
SMILES CCOC(=O)c1sc(nc1C)N(C(=O)/C=C/c1cnn(c1C)C)CC1CCCO1
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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 C20H26N4O4S MW 418.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H26N4O4S/c1-5-27-19(26)18-13(2)22-20(29-18)24(12-16-7-6-10-28-16)17(25)9-8-15-11-21-23(4)14(15)3/h8-9,11,16H,5-7,10,12H2,1-4H3/b9-8+InChIKey
IIAPWCAOOVCBGB-CMDGGOBGSA-NSynonyms
1006350-33-91006350339
CCOC(=O)C1=C(N=C(S1)N(CC2CCCO2)C(=O)C=CC3=C(N(N=C3)C)C)C
CCOC(=O)c1sc(nc1C)N(C(=O)C=Cc1cnn(c1C)C)CC1CCCO1
ethyl2(((2E)3(15dimethyl1Hpyrazol4yl)prop2enoyl)(tetrahydrofuran2ylmethyl)amino)4methyl13thiazole5carboxylate
ethyl2(((E)3(15dimethylpyrazol4yl)prop2enoyl)(oxolan2ylmethyl)amino)4methyl13thiazole5carboxylate
InChI=1SC20H26N4O4Sc152719(26)1813(2)2220(2918)24(121676102816)17(25)9815112123(4)14(15)3h891116H571012H214H3b98+
MFCD08554428
ZINC000013961415
ZINC000013961416
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