Vitas-M small molecule compound
6'-amino-4-bromo-3'-(4-butoxyphenyl)-5-methyl-2-oxo-1,2-dihydro-1'H-spiro[indole-3,4'-pyrano[2,3-c]pyrazole]-5'-carbonitrile
Catalog ID
STK764944
SMILES CCCCOc1ccc(cc1)c1n[nH]c2c1C1(C(=O)Nc3c1c(Br)c(cc3)C)C(=C(O2)N)C#N
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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 C25H22BrN5O3 MW 520.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22BrN5O3/c1-3-4-11-33-15-8-6-14(7-9-15)21-19-23(31-30-21)34-22(28)16(12-27)25(19)18-17(29-24(25)32)10-5-13(2)20(18)26/h5-10H,3-4,11,28H2,1-2H3,(H,29,32)(H,30,31)InChIKey
FEUZHDTZUHXGET-UHFFFAOYSA-NSynonyms
6amino4bromo3(4butoxyphenyl)5methyl2oxo12dihydro1Hspiro(indole34pyrano(23c)pyrazole)5carbonitrile
6AMINO4BROMO3(4BUTOXYPHENYL)5METHYL2OXOSPIRO(1HINDOLE342HPYRANO(23C)PYRAZOLE)5CARBONITRILE
CCCCOC1=CC=C(C=C1)C2=C3C(=NN2)OC(=C(C34C5=C(C=CC(=C5Br)C)NC4=O)C#N)N
CCCCOc1ccc(cc1)c1n(nH)c2c1C1(C(=O)Nc3c1c(Br)c(cc3)C)C(=C(O2)N)C#N
InChI=1SC25H22BrN5O3c1341133158614(7915)211923(313021)3422(28)16(1227)25(19)1817(2924(25)32)10513(2)20(18)26h510H341128H212H3(H2932)(H3031)
MFCD03035428
ZINC000008854880
ZINC000008854881
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