Vitas-M small molecule compound

4-{[(4,4-dimethyl-2,6-dioxocyclohexylidene)methyl]amino}-N-(4-methylpyrimidin-2-yl)benzenesulfonamide

Catalog ID
STK057062
SMILES Cc1ccnc(n1)NS(=O)(=O)c1ccc(cc1)NC=C1C(=O)CC(CC1=O)(C)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 C20H22N4O4S MW 414.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22N4O4S/c1-13-8-9-21-19(23-13)24-29(27,28)15-6-4-14(5-7-15)22-12-16-17(25)10-20(2,3)11-18(16)26/h4-9,12,22H,10-11H2,1-3H3,(H,21,23,24)
InChIKey
UTEUGHYEQFYZNN-UHFFFAOYSA-N
Synonyms
371947-39-6
371947396
4(((44DIMETHYL26DIOXOCYCLOHEXYLIDENE)METHYL)AMINO)N(4METHYLPYRIMIDIN2YL)BENZENESULFONAMIDE
4((44DIMETHYL26DIOXOCYCLOHEXYLIDENE)METHYLAMINO)N(4METHYLPYRIMIDIN2YL)BENZENESULFONAMIDE
4((44DIMETHYL26DIOXOCYCLOHEXYLIDENEMETHYL)AMINO)N(4METHYLPYRIMIDIN2YL)BENZENESULFONAMIDE
55DIMETHYL2(((4(((4METHYLPYRIMIDIN2YL)AMINO)SULFONYL)PHENYL)AMINO)METHYLENE)CYCLOHEXANE13DIONE
CC1=NC(=NC=C1)NS(=O)(=O)C2=CC=C(C=C2)NC=C3C(=O)CC(CC3=O)(C)C
Cc1ccnc(n1)NS(=O)(=O)c1ccc(cc1)NC=C1C(=O)CC(CC1=O)(C)C
InChI=1SC20H22N4O4Sc113892119(2313)2429(2728)156414(5715)22121617(25)1020(23)1118(16)26h491222H1011H213H3(H212324)
MFCD00129333
STK057062
ZINC000100142966
ZINC100142966

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Available files

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