Vitas-M small molecule compound
2-nitro-N-{2,2,2-trichloro-1-[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]ethyl}benzamide
Catalog ID
STK809405
SMILES N#Cc1c(sc2c1CCCC2)NC(C(Cl)(Cl)Cl)NC(=O)c1ccccc1[N+](=O)[O-]
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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 C18H15Cl3N4O3S MW 473.77 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H15Cl3N4O3S/c19-18(20,21)17(23-15(26)11-6-1-3-7-13(11)25(27)28)24-16-12(9-22)10-5-2-4-8-14(10)29-16/h1,3,6-7,17,24H,2,4-5,8H2,(H,23,26)InChIKey
HUIGASRORMGLJT-UHFFFAOYSA-NSynonyms
2nitroN(222trichloro1((3cyano4567tetrahydro1benzothiophen2yl)amino)ethyl)benzamide
C1CCC2=C(C1)C(=C(S2)NC(C(Cl)(Cl)Cl)NC(=O)C3=CC=CC=C3(N+)(=O)(O))C#N
InChI=1SC18H15Cl3N4O3Sc1918(2021)17(2315(26)11613713(11)25(27)28)241612(922)10524814(10)2916h13671724H2458H2(H2326)
MFCD00696387
N#Cc1c(sc2c1CCCC2)NC(C(Cl)(Cl)Cl)NC(=O)c1ccccc1(N+)(=O)(O)
ZINC000002678448
ZINC000002678449
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