Vitas-M small molecule compound
[3-chloro-5-(thiophen-2-yl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-2-yl][4-(furan-2-ylmethyl)piperazin-1-yl]methanone
Catalog ID
STL397898
SMILES O=C(c1nn2c(c1Cl)nc(cc2C(F)(F)F)c1cccs1)N1CCN(CC1)Cc1ccco1
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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 C21H17ClF3N5O2S MW 495.91 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H17ClF3N5O2S/c22-17-18(20(31)29-7-5-28(6-8-29)12-13-3-1-9-32-13)27-30-16(21(23,24)25)11-14(26-19(17)30)15-4-2-10-33-15/h1-4,9-11H,5-8,12H2InChIKey
NNPSBLOKIZCZDU-UHFFFAOYSA-NSynonyms
832126-20-2(3CHLORO5(THIOPHEN2YL)7(TRIFLUOROMETHYL)PYRAZOLO(15A)PYRIMIDIN2YL)(4(FURAN2YLMETHYL)PIPERAZIN1YL)METHANONE
(3chloro5thiophen2yl7(trifluoromethyl)pyrazolo(15a)pyrimidin2yl)(4(furan2ylmethyl)piperazin1yl)methanone
832126202
C1CN(CCN1CC2=CC=CO2)C(=O)C3=NN4C(=CC(=NC4=C3Cl)C5=CC=CS5)C(F)(F)F
InChI=1SC21H17ClF3N5O2Sc221718(20(31)297528(6829)12133193213)273016(21(2324)25)1114(2619(17)30)1542103315h14911H5812H2
MFCD04056898
ZINC000054972878
ZINC54972878
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