Vitas-M small molecule compound
1-cyclopentyl-4-(4-methoxyphenyl)-4,8-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepine-3,7(2H,6H)-dione
Catalog ID
STL491083
SMILES COc1ccc(cc1)C1SCC(=O)Nc2c1c(=O)[nH]n2C1CCCC1
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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 C18H21N3O3S MW 359.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H21N3O3S/c1-24-13-8-6-11(7-9-13)16-15-17(19-14(22)10-25-16)21(20-18(15)23)12-4-2-3-5-12/h6-9,12,16H,2-5,10H2,1H3,(H,19,22)(H,20,23)InChIKey
BFKNECLXUAZNKN-UHFFFAOYSA-NSynonyms
797772-88-4(4R)1CYCLOPENTYL4(4METHOXYPHENYL)48DIHYDRO1HPYRAZOLO(34E)(14)THIAZEPINE37(2H6H)DIONE
(4S)1CYCLOPENTYL4(4METHOXYPHENYL)48DIHYDRO1HPYRAZOLO(34E)(14)THIAZEPINE37(2H6H)DIONE
1CYCLOPENTYL3HYDROXY4(4METHOXYPHENYL)48DIHYDRO1HPYRAZOLO(34E)(14)THIAZEPIN7(6H)ONE
1cyclopentyl4(4methoxyphenyl)48dihydro1Hpyrazolo(34e)(14)thiazepine37(2H6H)dione
1CYCLOPENTYL4(4METHOXYPHENYL)48DIHYDRO2HPYRAZOLO(34E)(14)THIAZEPINE37DIONE
COC1=CC=C(C=C1)C2C3=C(NC(=O)CS2)N(NC3=O)C4CCCC4
COc1ccc(cc1)C1SCC(=O)Nc2c1c(=O)(nH)n2C1CCCC1
InChI=1SC18H21N3O3Sc124138611(7913)161517(1914(22)102516)21(2018(15)23)12423512h691216H2510H21H3(H1922)(H2023)
MFCD30714283
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.