Vitas-M small molecule compound
3-{3-[4-(azepan-1-ylsulfonyl)piperazin-1-yl]-3-oxopropyl}-2-hydroxy-3,4-dihydro-5H-1,4-benzodiazepin-5-one
Catalog ID
STL569322
SMILES OC1=Nc2ccccc2C(=O)NC1CCC(=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 C22H31N5O5S MW 477.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H31N5O5S/c28-20(10-9-19-22(30)23-18-8-4-3-7-17(18)21(29)24-19)25-13-15-27(16-14-25)33(31,32)26-11-5-1-2-6-12-26/h3-4,7-8,19H,1-2,5-6,9-16H2,(H,23,30)(H,24,29)InChIKey
DQICHWPRDZRSJO-UHFFFAOYSA-NSynonyms
132286153
3(3(4(azepan1ylsulfonyl)piperazin1yl)3oxopropyl)2hydroxy34dihydro5H14benzodiazepin5one
3(3(4(azepan1ylsulfonyl)piperazin1yl)3oxopropyl)34dihydro1H14benzodiazepine25dione
InChI=1SC22H31N5O5Sc2820(1091922(30)2318843717(18)21(29)2419)25131527(161425)33(3132)261151261226h347819H1256916H2(H2330)(H2429)
MFCD32654298
ZINC000524734426
ZINC000886025212
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