Vitas-M small molecule compound
5-(azepan-1-ylsulfonyl)-N-[3-(1H-imidazol-1-yl)propyl]-2-methylbenzamide
Catalog ID
STK346201
SMILES O=C(c1cc(ccc1C)S(=O)(=O)N1CCCCCC1)NCCCn1cncc1
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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 C20H28N4O3S MW 404.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H28N4O3S/c1-17-7-8-18(28(26,27)24-12-4-2-3-5-13-24)15-19(17)20(25)22-9-6-11-23-14-10-21-16-23/h7-8,10,14-16H,2-6,9,11-13H2,1H3,(H,22,25)InChIKey
YEADBMOFQMEYRY-UHFFFAOYSA-NSynonyms
5(azepan1ylsulfonyl)N(3(1Himidazol1yl)propyl)2methylbenzamide
5(azepan1ylsulfonyl)N(3imidazol1ylpropyl)2methylbenzamide
CC1=C(C=C(C=C1)S(=O)(=O)N2CCCCCC2)C(=O)NCCCN3C=CN=C3
InChI=1SC20H28N4O3Sc1177818(28(2627)241242351324)1519(17)20(25)229611231410211623h78101416H2691113H21H3(H2225)
MFCD09965151
ZINC000012950451
ZINC12950451
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