Vitas-M small molecule compound
3-{2-[4-(azepan-1-ylsulfonyl)piperazin-1-yl]-2-oxoethyl}-2-hydroxy-3,4-dihydro-5H-1,4-benzodiazepin-5-one
Catalog ID
STL567768
SMILES OC1=Nc2ccccc2C(=O)NC1CC(=O)N1CCN(CC1)S(=O)(=O)N1CCCCCC1
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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 C21H29N5O5S MW 463.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H29N5O5S/c27-19(15-18-21(29)22-17-8-4-3-7-16(17)20(28)23-18)24-11-13-26(14-12-24)32(30,31)25-9-5-1-2-6-10-25/h3-4,7-8,18H,1-2,5-6,9-15H2,(H,22,29)(H,23,28)InChIKey
YWTYXFPHPNHCSZ-UHFFFAOYSA-NSynonyms
132285951
3(2(4(azepan1ylsulfonyl)piperazin1yl)2oxoethyl)2hydroxy34dihydro5H14benzodiazepin5one
3(2(4(azepan1ylsulfonyl)piperazin1yl)2oxoethyl)34dihydro1H14benzodiazepine25dione
InChI=1SC21H29N5O5Sc2719(151821(29)2217843716(17)20(28)2318)24111326(141224)32(3031)25951261025h347818H1256915H2(H2229)(H2328)
MFCD32652950
ZINC000524733881
ZINC000886025746
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