Vitas-M small molecule compound

2-{[N-(1,3-benzodioxol-5-yl)-N-(methylsulfonyl)glycyl]amino}-N-(butan-2-yl)benzamide

Catalog ID
STL087385
SMILES CCC(NC(=O)c1ccccc1NC(=O)CN(S(=O)(=O)C)c1ccc2c(c1)OCO2)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 C21H25N3O6S MW 447.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H25N3O6S/c1-4-14(2)22-21(26)16-7-5-6-8-17(16)23-20(25)12-24(31(3,27)28)15-9-10-18-19(11-15)30-13-29-18/h5-11,14H,4,12-13H2,1-3H3,(H,22,26)(H,23,25)
InChIKey
CEWFUJSGKVUKHA-UHFFFAOYSA-N
Synonyms

2((2(13BENZODIOXOL5YL(METHYLSULFONYL)AMINO)ACETYL)AMINO)NBUTAN2YLBENZAMIDE
2((N(13benzodioxol5yl)N(methylsulfonyl)glycyl)amino)N(butan2yl)benzamide
CCC(C)NC(=O)C1=CC=CC=C1NC(=O)CN(C2=CC3=C(C=C2)OCO3)S(=O)(=O)C
InChI=1SC21H25N3O6Sc1414(2)2221(26)16756817(16)2320(25)1224(31(327)28)159101819(1115)30132918h51114H41213H213H3(H2226)(H2325)
MFCD05837045
ZINC000001066850
ZINC000001066851

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Available files

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