Vitas-M small molecule compound

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

Catalog ID
STK125909
SMILES Cc1cc(C)nc(n1)NS(=O)(=O)c1ccc(cc1)NC(=O)c1sc2c(c1Cl)cccc2

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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 C21H17ClN4O3S2 MW 472.98 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H17ClN4O3S2/c1-12-11-13(2)24-21(23-12)26-31(28,29)15-9-7-14(8-10-15)25-20(27)19-18(22)16-5-3-4-6-17(16)30-19/h3-11H,1-2H3,(H,25,27)(H,23,24,26)
InChIKey
YVXPTZKSWBKBEZ-UHFFFAOYSA-N
Synonyms
215778-05-5
215778055
3CHLORON(4(((46DIMETHYL2PYRIMIDINYL)AMINO)SULFONYL)PHENYL)1BENZO(B)THIOPHENE2CARBOXAMIDE
3CHLORON(4((46DIMETHYLPYRIMIDIN2YL)SULFAMOYL)PHENYL)1BENZOTHIOPHENE2CARBOXAMIDE
3CHLORON(4(N(46DIMETHYLPYRIMIDIN2YL)SULFAMOYL)PHENYL)BENZO(B)THIOPHENE2CARBOXAMIDE
CC1=CC(=NC(=N1)NS(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=C(C4=CC=CC=C4S3)Cl)C
InChI=1SC21H17ClN4O3S2c1121113(2)2421(2312)2631(2829)159714(81015)2520(27)1918(22)16534617(16)3019h311H12H3(H2527)(H232426)
MFCD00115376
N2(4(((46DIMETHYLPYRIMIDIN2YL)AMINO)SULFONYL)PHENYL)3CHLOROBENZO(B)THIOPHENE2CARBOXAMIDE
ZINC000000945483
ZINC00945483
ZINC945483

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.