Vitas-M small molecule compound

3-chloro-N-({4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl}carbamothioyl)-6-fluoro-1-benzothiophene-2-carboxamide

Catalog ID
STK542328
SMILES S=C(NC(=O)c1sc2c(c1Cl)ccc(c2)F)Nc1ccc(cc1)S(=O)(=O)Nc1nc(C)cc(n1)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 C22H17ClFN5O3S3 MW 550.06 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H17ClFN5O3S3/c1-11-9-12(2)26-21(25-11)29-35(31,32)15-6-4-14(5-7-15)27-22(33)28-20(30)19-18(23)16-8-3-13(24)10-17(16)34-19/h3-10H,1-2H3,(H,25,26,29)(H2,27,28,30,33)
InChIKey
YQZPIVNHVMWDBH-UHFFFAOYSA-N
Synonyms
331443-70-0
331443700
3chloroN((4((46dimethylpyrimidin2yl)sulfamoyl)phenyl)carbamothioyl)6fluoro1benzothiophene2carboxamide
3chloroN((4(N(46dimethylpyrimidin2yl)sulfamoyl)phenyl)carbamothioyl)6fluorobenzo(b)thiophene2carboxamide
CC1=CC(=NC(=N1)NS(=O)(=O)C2=CC=C(C=C2)NC(=S)NC(=O)C3=C(C4=C(S3)C=C(C=C4)F)Cl)C
InChI=1SC22H17ClFN5O3S3c111912(2)2621(2511)2935(3132)156414(5715)2722(33)2820(30)1918(23)168313(24)1017(16)3419h310H12H3(H252629)(H227283033)
MFCD00753408
ZINC000003094455
ZINC03094455
ZINC3094455

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Available files

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