Vitas-M small molecule compound
6'-amino-7-bromo-3',5-dimethyl-2-oxo-1'-phenyl-1,2-dihydro-1'H-spiro[indole-3,4'-pyrano[2,3-c]pyrazole]-5'-carbonitrile
Catalog ID
STK980351
SMILES N#CC1=C(N)Oc2c(C31C(=O)Nc1c3cc(C)cc1Br)c(C)nn2c1ccccc1
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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 C22H16BrN5O2 MW 462.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H16BrN5O2/c1-11-8-14-18(16(23)9-11)26-21(29)22(14)15(10-24)19(25)30-20-17(22)12(2)27-28(20)13-6-4-3-5-7-13/h3-9H,25H2,1-2H3,(H,26,29)InChIKey
OKZFOTBTZQYUEG-UHFFFAOYSA-NSynonyms
6amino7bromo35dimethyl2oxo1phenyl12dihydro1Hspiro(indole34pyrano(23c)pyrazole)5carbonitrile
6AMINO7BROMO35DIMETHYL2OXO1PHENYLSPIRO(1HINDOLE34PYRANO(23C)PYRAZOLE)5CARBONITRILE
CC1=CC(=C2C(=C1)C3(C(=C(OC4=C3C(=NN4C5=CC=CC=C5)C)N)C#N)C(=O)N2)Br
InChI=1SC22H16BrN5O2c11181418(16(23)911)2621(29)22(14)15(1024)19(25)302017(22)12(2)2728(20)136435713h39H25H212H3(H2629)
MFCD05988359
ZINC000001116103
ZINC000001116105
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