Vitas-M small molecule compound

2-{[4-chloro-5-cyclopropyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]methyl}-9-(difluoromethyl)-7-methylpyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[1,5-c]pyrimidine

Catalog ID
STL394494
SMILES FC(c1cc(C)c2c(n1)sc1c2ncn2c1nc(n2)Cn1nc(c(c1C1CC1)Cl)C(F)(F)F)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 C20H13ClF5N7S MW 513.88 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H13ClF5N7S/c1-7-4-9(17(22)23)28-19-11(7)13-15(34-19)18-29-10(30-33(18)6-27-13)5-32-14(8-2-3-8)12(21)16(31-32)20(24,25)26/h4,6,8,17H,2-3,5H2,1H3
InChIKey
SONBBXRSBPPJOY-UHFFFAOYSA-N
Synonyms
1006335-87-0
1006335870
2((4chloro5cyclopropyl3(trifluoromethyl)1Hpyrazol1yl)methyl)9(difluoromethyl)7methylpyrido(3245)thieno(23e)(124)triazolo(15c)pyrimidine
CC1=CC(=NC2=C1C3=C(S2)C4=NC(=NN4C=N3)CN5C(=C(C(=N5)C(F)(F)F)Cl)C6CC6)C(F)F
InChI=1SC20H13ClF5N7Sc1749(17(22)23)281911(7)1315(3419)182910(3033(18)62713)53214(8238)12(21)16(3132)20(2425)26h46817H235H21H3
MFCD08554124
ZINC000097945233
ZINC97945233

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Available files

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