Vitas-M small molecule compound
4-(1-benzyl-1H-pyrazol-4-yl)-5-{[3-(difluoromethyl)-5-methyl-1H-pyrazol-1-yl]methyl}-4H-1,2,4-triazole-3-thiol
Catalog ID
STK311018
SMILES FC(c1cc(n(n1)Cc1nnc(n1c1cnn(c1)Cc1ccccc1)S)C)F
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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 C18H17F2N7S MW 401.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H17F2N7S/c1-12-7-15(17(19)20)24-26(12)11-16-22-23-18(28)27(16)14-8-21-25(10-14)9-13-5-3-2-4-6-13/h2-8,10,17H,9,11H2,1H3,(H,23,28)InChIKey
KHIFOAZZJPCTGL-UHFFFAOYSA-NSynonyms
1005604-76-11005604761
4(1benzyl1Hpyrazol4yl)5((3(difluoromethyl)5methyl1Hpyrazol1yl)methyl)4H124triazole3thiol
4(1benzylpyrazol4yl)3((3(difluoromethyl)5methylpyrazol1yl)methyl)1H124triazole5thione
5((3(DIFLUOROMETHYL)5METHYLPYRAZOLYL)METHYL)4(1BENZYLPYRAZOL4YL)124TRIAZOLE3THIOL
CC1=CC(=NN1CC2=NNC(=S)N2C3=CN(N=C3)CC4=CC=CC=C4)C(F)F
InChI=1SC18H17F2N7Sc112715(17(19)20)2426(12)1116222318(28)27(16)1482125(1014)9135324613h281017H911H21H3(H2328)
MFCD04058889
ZINC000002808257
ZINC02808257
ZINC2808257
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