Vitas-M small molecule compound
(5-chlorothiophen-2-yl)[7-(1,5-dimethyl-1H-pyrazol-4-yl)-5-(trifluoromethyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]methanone
Catalog ID
STL391784
SMILES Clc1ccc(s1)C(=O)C1=C(Nc2n(C1c1cnn(c1C)C)ncn2)C(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 C16H12ClF3N6OS MW 428.83 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H12ClF3N6OS/c1-7-8(5-22-25(7)2)12-11(13(27)9-3-4-10(17)28-9)14(16(18,19)20)24-15-21-6-23-26(12)15/h3-6,12H,1-2H3,(H,21,23,24)InChIKey
DQBVVZCSAWBVPS-UHFFFAOYSA-NSynonyms
1005662-68-9(5chlorothiophen2yl)(7(15dimethyl1Hpyrazol4yl)5(trifluoromethyl)47dihydro(124)triazolo(15a)pyrimidin6yl)methanone
(5chlorothiophen2yl)(7(15dimethylpyrazol4yl)5(trifluoromethyl)17dihydro(124)triazolo(15a)pyrimidin6yl)methanone
1005662689
CC1=C(C=NN1C)C2C(=C(N=C3N2NC=N3)C(F)(F)F)C(=O)C4=CC=C(S4)Cl
InChI=1SC16H12ClF3N6OSc178(52225(7)2)1211(13(27)93410(17)289)14(16(1819)20)24152162326(12)15h3612H12H3(H212324)
MFCD06197203
ZINC000017096169
ZINC000017096170
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