Vitas-M small molecule compound
2-{[4-(4-chlorophenyl)-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)acetamide
Catalog ID
STK328688
SMILES O=C(Nc1c(=O)n(n(c1C)C)c1ccccc1)CSc1nnc(n1c1ccc(cc1)Cl)c1ccncc1
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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 C26H22ClN7O2S MW 532.03 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H22ClN7O2S/c1-17-23(25(36)34(32(17)2)21-6-4-3-5-7-21)29-22(35)16-37-26-31-30-24(18-12-14-28-15-13-18)33(26)20-10-8-19(27)9-11-20/h3-15H,16H2,1-2H3,(H,29,35)InChIKey
VMGCAAKATMSJIG-UHFFFAOYSA-NSynonyms
889948-79-22((4(4chlorophenyl)5(pyridin4yl)4H124triazol3yl)sulfanyl)N(15dimethyl3oxo2phenyl23dihydro1Hpyrazol4yl)acetamide
2((4(4CHLOROPHENYL)5PYRIDIN4YL124TRIAZOL3YL)SULFANYL)N(15DIMETHYL3OXO2PHENYLPYRAZOL4YL)ACETAMIDE
889948792
CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=O)CSC3=NN=C(N3C4=CC=C(C=C4)Cl)C5=CC=NC=C5
InChI=1SC26H22ClN7O2Sc11723(25(36)34(32(17)2)216435721)2922(35)163726313024(18121428151318)33(26)2010819(27)91120h315H16H212H3(H2935)
MFCD06617302
ZINC000098008152
ZINC98008152
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