Vitas-M small molecule compound
propan-2-yl 2-({[5-(4-nitrophenyl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidin-2-yl]carbonyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK343461
SMILES CC(OC(=O)c1c(NC(=O)c2cc3n(n2)C(CC(N3)c2ccc(cc2)[N+](=O)[O-])C(F)(F)F)sc2c1CCCC2)C
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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 C26H26F3N5O5S MW 577.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H26F3N5O5S/c1-13(2)39-25(36)22-16-5-3-4-6-19(16)40-24(22)31-23(35)18-12-21-30-17(11-20(26(27,28)29)33(21)32-18)14-7-9-15(10-8-14)34(37)38/h7-10,12-13,17,20,30H,3-6,11H2,1-2H3,(H,31,35)InChIKey
UYTIPFIXSXUXHB-UHFFFAOYSA-NSynonyms
380579-59-9380579599
CC(OC(=O)c1c(NC(=O)c2cc3n(n2)C(CC(N3)c2ccc(cc2)(N+)(=O)(O))C(F)(F)F)sc2c1CCCC2)C
isopropyl2(5(4nitrophenyl)7(trifluoromethyl)4567tetrahydropyrazolo(15a)pyrimidine2carboxamido)4567tetrahydrobenzo(b)thiophene3carboxylate
MFCD01923657
propan2yl2(((5(4nitrophenyl)7(trifluoromethyl)4567tetrahydropyrazolo(15a)pyrimidin2yl)carbonyl)amino)4567tetrahydro1benzothiophene3carboxylate
ZINC000001811156
ZINC000001811161
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