Vitas-M small molecule compound
2-(2,3-dimethylphenoxy)-N-({4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl}carbonothioyl)acetamide
Catalog ID
STK248025
SMILES O=C(NC(=S)N1CCN(CC1)c1ccc(cc1[N+](=O)[O-])C(F)(F)F)COc1cccc(c1C)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 C22H23F3N4O4S MW 496.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23F3N4O4S/c1-14-4-3-5-19(15(14)2)33-13-20(30)26-21(34)28-10-8-27(9-11-28)17-7-6-16(22(23,24)25)12-18(17)29(31)32/h3-7,12H,8-11,13H2,1-2H3,(H,26,30,34)InChIKey
ZHCSFJOLZRERLR-UHFFFAOYSA-NSynonyms
2(23dimethylphenoxy)N((4(2nitro4(trifluoromethyl)phenyl)piperazin1yl)carbonothioyl)acetamide
2(23dimethylphenoxy)N(4(2nitro4(trifluoromethyl)phenyl)piperazine1carbothioyl)acetamide
CC1=C(C(=CC=C1)OCC(=O)NC(=S)N2CCN(CC2)C3=C(C=C(C=C3)C(F)(F)F)(N+)(=O)(O))C
InChI=1SC22H23F3N4O4Sc11443519(15(14)2)331320(30)2621(34)2810827(91128)177616(22(2324)25)1218(17)29(31)32h3712H81113H212H3(H263034)
MFCD08575306
O=C(NC(=S)N1CCN(CC1)c1ccc(cc1(N+)(=O)(O))C(F)(F)F)COc1cccc(c1C)C
ZINC000008814634
ZINC08814634
ZINC8814634
Check stock
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