Vitas-M small molecule compound

methyl 1-{[2-({[4-(dimethylsulfamoyl)phenyl]carbonyl}amino)phenyl]sulfonyl}prolinate

Catalog ID
STK737037
SMILES COC(=O)C1CCCN1S(=O)(=O)c1ccccc1NC(=O)c1ccc(cc1)S(=O)(=O)N(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 C21H25N3O7S2 MW 495.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H25N3O7S2/c1-23(2)32(27,28)16-12-10-15(11-13-16)20(25)22-17-7-4-5-9-19(17)33(29,30)24-14-6-8-18(24)21(26)31-3/h4-5,7,9-13,18H,6,8,14H2,1-3H3,(H,22,25)
InChIKey
KDBUKSXZZGAODP-UHFFFAOYSA-N
Synonyms

CN(C)S(=O)(=O)C1=CC=C(C=C1)C(=O)NC2=CC=CC=C2S(=O)(=O)N3CCCC3C(=O)OC
InChI=1SC21H25N3O7S2c123(2)32(2728)16121015(111316)20(25)2217745919(17)33(2930)24146818(24)21(26)313h45791318H6814H213H3(H2225)
methyl1((2(((4(dimethylsulfamoyl)phenyl)carbonyl)amino)phenyl)sulfonyl)prolinate
METHYL1(2((4(DIMETHYLSULFAMOYL)BENZOYL)AMINO)PHENYL)SULFONYLPYRROLIDINE2CARBOXYLATE
MFCD06619454
ZINC000012413995
ZINC000015022332

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Available files

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