Vitas-M small molecule compound
4-tert-butyl-N-{[2-(pentafluorophenyl)-1,3-benzoxazol-5-yl]carbamothioyl}benzamide
Catalog ID
STK381263
SMILES S=C(NC(=O)c1ccc(cc1)C(C)(C)C)Nc1ccc2c(c1)nc(o2)c1c(F)c(F)c(c(c1F)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 C25H18F5N3O2S MW 519.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H18F5N3O2S/c1-25(2,3)12-6-4-11(5-7-12)22(34)33-24(36)31-13-8-9-15-14(10-13)32-23(35-15)16-17(26)19(28)21(30)20(29)18(16)27/h4-10H,1-3H3,(H2,31,33,34,36)InChIKey
QJFXJDIPGPODDS-UHFFFAOYSA-NSynonyms
4tertbutylN((2(23456pentafluorophenyl)13benzoxazol5yl)carbamothioyl)benzamide
4tertbutylN((2(pentafluorophenyl)13benzoxazol5yl)carbamothioyl)benzamide
CC(C)(C)C1=CC=C(C=C1)C(=O)NC(=S)NC2=CC3=C(C=C2)OC(=N3)C4=C(C(=C(C(=C4F)F)F)F)F
InChI=1SC25H18F5N3O2Sc125(23)126411(5712)22(34)3324(36)3113891514(1013)3223(3515)1617(26)19(28)21(30)20(29)18(16)27h410H13H3(H231333436)
MFCD03549090
ZINC000004090492
ZINC4090492
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