Vitas-M small molecule compound

2-(4-chloro-2-methylphenoxy)-N-{4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl}acetamide

Catalog ID
STK011280
SMILES O=C(Nc1ccc(cc1)S(=O)(=O)Nc1nc(C)cc(n1)C)COc1ccc(cc1C)Cl

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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 C21H21ClN4O4S MW 460.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21ClN4O4S/c1-13-10-16(22)4-9-19(13)30-12-20(27)25-17-5-7-18(8-6-17)31(28,29)26-21-23-14(2)11-15(3)24-21/h4-11H,12H2,1-3H3,(H,25,27)(H,23,24,26)
InChIKey
SAMYNZKNYCXMDI-UHFFFAOYSA-N
Synonyms

2(4CHLORO2METHYLPHENOXY)N(4(((46DIMETHYL2PYRIMIDINYL)AMINO)SULFONYL)PHENYL)ACETAMIDE
2(4CHLORO2METHYLPHENOXY)N(4((46DIMETHYLPYRIMIDIN2YL)SULFAMOYL)PHENYL)ACETAMIDE
CC1=CC(=NC(=N1)NS(=O)(=O)C2=CC=C(C=C2)NC(=O)COC3=C(C=C(C=C3)Cl)C)C
InChI=1SC21H21ClN4O4Sc1131016(22)4919(13)301220(27)25175718(8617)31(2829)26212314(2)1115(3)2421h411H12H213H3(H2527)(H232426)
MFCD02603180
O=C(Nc1ccc(cc1)S(=O)(=O)Nc1nc(C)cc(n1)C)COc1ccc(cc1C)Cl
STK011280
ZINC000002774126
ZINC2774126

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Available files

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