Vitas-M small molecule compound
4-(4-bromophenyl)-1-(butan-2-yl)-3-hydroxy-4,8-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-7(6H)-one
Catalog ID
STL236088
SMILES CCC(n1nc(c2c1NC(=O)CSC2c1ccc(cc1)Br)O)C
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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 C16H18BrN3O2S MW 396.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H18BrN3O2S/c1-3-9(2)20-15-13(16(22)19-20)14(23-8-12(21)18-15)10-4-6-11(17)7-5-10/h4-7,9,14H,3,8H2,1-2H3,(H,18,21)(H,19,22)InChIKey
SBJFJHYJKLANMY-UHFFFAOYSA-NSynonyms
797796-55-5(4S)4(4BROMOPHENYL)1((2R)BUTAN2YL)48DIHYDRO1HPYRAZOLO(34E)(14)THIAZEPINE37(2H6H)DIONE
4(4bromophenyl)1(butan2yl)3hydroxy48dihydro1Hpyrazolo(34e)(14)thiazepin7(6H)one
4(4bromophenyl)1(secbutyl)3hydroxy68dihydro1Hpyrazolo(34e)(14)thiazepin7(4H)one
4(4BROMOPHENYL)1BUTAN2YL48DIHYDRO2HPYRAZOLO(34E)(14)THIAZEPINE37DIONE
797796555
CCC(C)N1C2=C(C(SCC(=O)N2)C3=CC=C(C=C3)Br)C(=O)N1
InChI=1SC16H18BrN3O2Sc139(2)201513(16(22)1920)14(23812(21)1815)104611(17)7510h47914H38H212H3(H1821)(H1922)
MFCD03667205
ZINC000005791191
ZINC000005791234
Check stock
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