Vitas-M small molecule compound
2-{[3-(4-ethoxyphenyl)-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl]sulfanyl}-N-[2-(trifluoromethyl)phenyl]acetamide
Catalog ID
STK080569
SMILES CCOc1ccc(cc1)n1c(SCC(=O)Nc2ccccc2C(F)(F)F)nc2c(c1=O)c1CCCCc1s2
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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 C27H24F3N3O3S2 MW 559.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H24F3N3O3S2/c1-2-36-17-13-11-16(12-14-17)33-25(35)23-18-7-3-6-10-21(18)38-24(23)32-26(33)37-15-22(34)31-20-9-5-4-8-19(20)27(28,29)30/h4-5,8-9,11-14H,2-3,6-7,10,15H2,1H3,(H,31,34)InChIKey
IXYLTLQXYQXYQJ-UHFFFAOYSA-NSynonyms
2((3(4ethoxyphenyl)4oxo345678hexahydro(1)benzothieno(23d)pyrimidin2yl)sulfanyl)N(2(trifluoromethyl)phenyl)acetamide
2((3(4ethoxyphenyl)4oxo345678hexahydrobenzo(45)thieno(23d)pyrimidin2yl)thio)N(2(trifluoromethyl)phenyl)acetamide
2((3(4ethoxyphenyl)4oxo5678tetrahydro(1)benzothiolo(23d)pyrimidin2yl)sulfanyl)N(2(trifluoromethyl)phenyl)acetamide
CCOC1=CC=C(C=C1)N2C(=O)C3=C(N=C2SCC(=O)NC4=CC=CC=C4C(F)(F)F)SC5=C3CCCC5
CCOc1ccc(cc1)n1c(SCC(=O)Nc2ccccc2C(F)(F)F)nc2c(c1=O)c1CCCCc1s2
InChI=1SC27H24F3N3O3S2c123617131116(121417)3325(35)23187361021(18)3824(23)3226(33)371522(34)3120954819(20)27(2829)30h45891114H23671015H21H3(H3134)
MFCD03224540
STK080569
ZINC000002506980
ZINC2506980
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Check stock on Vitas-MAvailable files
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