Vitas-M small molecule compound

ethyl 1-[(2,4-dimethylphenyl)sulfonyl]-5-{[(2,4-dimethylphenyl)sulfonyl]amino}-2-methyl-1H-indole-3-carboxylate

Catalog ID
STK238399
SMILES CCOC(=O)c1c2cc(ccc2n(c1C)S(=O)(=O)c1ccc(cc1C)C)NS(=O)(=O)c1ccc(cc1C)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 C28H30N2O6S2 MW 554.69 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H30N2O6S2/c1-7-36-28(31)27-21(6)30(38(34,35)26-13-9-18(3)15-20(26)5)24-11-10-22(16-23(24)27)29-37(32,33)25-12-8-17(2)14-19(25)4/h8-16,29H,7H2,1-6H3
InChIKey
XNNWYXUMPGZSKG-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1=C(N(C2=C1C=C(C=C2)NS(=O)(=O)C3=C(C=C(C=C3)C)C)S(=O)(=O)C4=C(C=C(C=C4)C)C)C
ethyl1((24dimethylphenyl)sulfonyl)5(((24dimethylphenyl)sulfonyl)amino)2methyl1Hindole3carboxylate
ETHYL1((24DIMETHYLPHENYL)SULFONYL)5(((24DIMETHYLPHENYL)SULFONYL)AMINO)2METHYLINDOLE3CARBOXYLATE
ethyl1(24dimethylphenyl)sulfonyl5((24dimethylphenyl)sulfonylamino)2methylindole3carboxylate
InChI=1SC28H30N2O6S2c173628(31)2721(6)30(38(3435)2613918(3)1520(26)5)24111022(1623(24)27)2937(3233)2512817(2)1419(25)4h81629H7H216H3
MFCD01136767
ZINC000000944053
ZINC944053

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Available files

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