Vitas-M small molecule compound
3-hydroxy-7,7-dimethyl-4-[4-(propan-2-yl)phenyl]-1,4,6,7,8,9-hexahydro-5H-pyrazolo[3,4-b]quinolin-5-one
Catalog ID
STK333246
SMILES CC(c1ccc(cc1)C1C2=C(Nc3c1c(O)n[nH]3)CC(CC2=O)(C)C)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 C21H25N3O2 MW 351.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H25N3O2/c1-11(2)12-5-7-13(8-6-12)16-17-14(9-21(3,4)10-15(17)25)22-19-18(16)20(26)24-23-19/h5-8,11,16H,9-10H2,1-4H3,(H3,22,23,24,26)InChIKey
WEDOSOKPIVSJKO-UHFFFAOYSA-NSynonyms
3hydroxy77dimethyl4(4(propan2yl)phenyl)146789hexahydro5Hpyrazolo(34b)quinolin5one
77dimethyl4(4propan2ylphenyl)124689hexahydropyrazolo(34b)quinoline35dione
CC(C)C1=CC=C(C=C1)C2C3=C(CC(CC3=O)(C)C)NC4=C2C(=O)NN4
CC(c1ccc(cc1)C1C2=C(Nc3c1c(O)n(nH)3)CC(CC2=O)(C)C)C
InChI=1SC21H25N3O2c111(2)125713(8612)161714(921(34)1015(17)25)221918(16)20(26)242319h581116H910H214H3(H322232426)
MFCD09962915
ZINC000012347569
ZINC000012347580
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