Vitas-M small molecule compound
2-{[1-(4-chlorophenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]sulfanyl}-N-[2-chloro-5-(trifluoromethyl)phenyl]acetamide
Catalog ID
STL348994
SMILES O=C(Nc1cc(ccc1Cl)C(F)(F)F)CSc1ncnc2c1cnn2c1ccc(cc1)Cl
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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 C20H12Cl2F3N5OS MW 498.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H12Cl2F3N5OS/c21-12-2-4-13(5-3-12)30-18-14(8-28-30)19(27-10-26-18)32-9-17(31)29-16-7-11(20(23,24)25)1-6-15(16)22/h1-8,10H,9H2,(H,29,31)InChIKey
XEDGFGKEFDWYOM-UHFFFAOYSA-NSynonyms
862200-13-32((1(4chlorophenyl)1Hpyrazolo(34d)pyrimidin4yl)sulfanyl)N(2chloro5(trifluoromethyl)phenyl)acetamide
2(1(4CHLOROPHENYL)PYRAZOLO(34D)PYRIMIDIN4YL)SULFANYLN(2CHLORO5(TRIFLUOROMETHYL)PHENYL)ACETAMIDE
862200133
C1=CC(=CC=C1N2C3=C(C=N2)C(=NC=N3)SCC(=O)NC4=C(C=CC(=C4)C(F)(F)F)Cl)Cl
InChI=1SC20H12Cl2F3N5OSc21122413(5312)301814(82830)19(27102618)32917(31)2916711(20(2324)25)1615(16)22h1810H9H2(H2931)
MFCD05697327
N(2chloro5(trifluoromethyl)phenyl)2((1(4chlorophenyl)1Hpyrazolo(34d)pyrimidin4yl)thio)acetamide
ZINC000008902914
ZINC08902914
ZINC8902914
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