Vitas-M small molecule compound
4-(4-butoxyphenyl)-1,3-diphenyl-4,8-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-7(6H)-one
Catalog ID
STK544671
SMILES CCCCOc1ccc(cc1)C1SCC(=O)Nc2c1c(nn2c1ccccc1)c1ccccc1
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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 C28H27N3O2S MW 469.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H27N3O2S/c1-2-3-18-33-23-16-14-21(15-17-23)27-25-26(20-10-6-4-7-11-20)30-31(22-12-8-5-9-13-22)28(25)29-24(32)19-34-27/h4-17,27H,2-3,18-19H2,1H3,(H,29,32)InChIKey
NYUOGUDQBDSHBJ-UHFFFAOYSA-NSynonyms
500280-30-84(4butoxyphenyl)13diphenyl48dihydro1Hpyrazolo(34e)(14)thiazepin7(6H)one
4(4butoxyphenyl)13diphenyl68dihydro1Hpyrazolo(34e)(14)thiazepin7(4H)one
500280308
MFCD03303523
ZINC000001772029
ZINC000001772032
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