Vitas-M small molecule compound
1,4-diazepane-1,4-diylbis{[5-(5-chlorothiophen-2-yl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-2-yl]methanone}
Catalog ID
STK449712
SMILES Clc1ccc(s1)c1nc2cc(nn2c(c1)C(F)(F)F)C(=O)N1CCCN(CC1)C(=O)c1nn2c(c1)nc(cc2C(F)(F)F)c1ccc(s1)Cl
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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 C29H18Cl2F6N8O2S2 MW 759.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H18Cl2F6N8O2S2/c30-22-4-2-18(48-22)14-10-20(28(32,33)34)44-24(38-14)12-16(40-44)26(46)42-6-1-7-43(9-8-42)27(47)17-13-25-39-15(19-3-5-23(31)49-19)11-21(29(35,36)37)45(25)41-17/h2-5,10-13H,1,6-9H2InChIKey
PAAFHDRXCXXNDW-UHFFFAOYSA-NSynonyms
(4(5(5CHLOROTHIOPHEN2YL)7(TRIFLUOROMETHYL)PYRAZOLO(15A)PYRIMIDINE2CARBONYL)14DIAZEPAN1YL)(5(5CHLOROTHIOPHEN2YL)7(TRIFLUOROMETHYL)PYRAZOLO(15A)PYRIMIDIN2YL)METHANONE
14diazepane14diylbis((5(5chlorothiophen2yl)7(trifluoromethyl)pyrazolo(15a)pyrimidin2yl)methanone)
5(5CHLORO(2THIENYL))7(TRIFLUOROMETHYL)(8HYDROPYRAZOLO(15A)PYRIMIDIN2YL)4((5(5CHLORO(2THIENYL))7(TRIFLUOROMETHYL)(8HYDROPYRAZOLO(15A)PYRIMIDIN2YL))CARBONYL)(14DIAZAPERHYDROEPINYL)KETONE
5(5CHLORO2THIENYL)2((4((5(5CHLORO2THIENYL)7(TRIFLUOROMETHYL)PYRAZOLO(15A)PYRIMIDIN2YL)CARBONYL)14DIAZEPAN1YL)CARBONYL)7(TRIFLUOROMETHYL)PYRAZOLO(15A)PYRIMIDINE
C1CN(CCN(C1)C(=O)C2=NN3C(=CC(=NC3=C2)C4=CC=C(S4)Cl)C(F)(F)F)C(=O)C5=NN6C(=CC(=NC6=C5)C7=CC=C(S7)Cl)C(F)(F)F
InChI=1SC29H18Cl2F6N8O2S2c30224218(4822)141020(28(3233)34)4424(3814)1216(4044)26(46)4261743(9842)27(47)1713253915(193523(31)4919)1121(29(3536)37)45(25)4117h251013H169H2
MFCD03468141
ZINC000008455359
ZINC08455359
ZINC8455359
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