Vitas-M small molecule compound
1-cycloheptyl-6-methyl-4-[4-(trifluoromethyl)phenyl]-1,4-dihydropyrazolo[3,4-d][1,3]thiazin-3(2H)-one
Catalog ID
STL434169
SMILES CC1=Nc2c(C(S1)c1ccc(cc1)C(F)(F)F)c(=O)[nH]n2C1CCCCCC1
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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 C20H22F3N3OS MW 409.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22F3N3OS/c1-12-24-18-16(19(27)25-26(18)15-6-4-2-3-5-7-15)17(28-12)13-8-10-14(11-9-13)20(21,22)23/h8-11,15,17H,2-7H2,1H3,(H,25,27)InChIKey
LPOFSJAKTQUDBK-UHFFFAOYSA-NSynonyms
1cycloheptyl6methyl4(4(trifluoromethyl)phenyl)14dihydropyrazolo(34d)(13)thiazin3(2H)one
1cycloheptyl6methyl4(4(trifluoromethyl)phenyl)24dihydropyrazolo(34d)(13)thiazin3one
CC1=NC2=C(C(S1)C3=CC=C(C=C3)C(F)(F)F)C(=O)NN2C4CCCCCC4
CC1=Nc2c(C(S1)c1ccc(cc1)C(F)(F)F)c(=O)(nH)n2C1CCCCCC1
InChI=1SC20H22F3N3OSc112241816(19(27)2526(18)1564235715)17(2812)1381014(11913)20(2122)23h8111517H27H21H3(H2527)
MFCD26098617
ZINC000085411834
ZINC000085411838
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