Vitas-M small molecule compound
methyl [6'-amino-5'-cyano-3'-(2,5-dimethoxyphenyl)-2-oxo-1'H-spiro[indole-3,4'-pyrano[2,3-c]pyrazol]-1(2H)-yl]acetate
Catalog ID
STK765332
SMILES COC(=O)CN1c2ccccc2C2(C1=O)C(=C(N)Oc1c2c(n[nH]1)c1cc(OC)ccc1OC)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 C25H21N5O6 MW 487.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H21N5O6/c1-33-13-8-9-18(34-2)14(10-13)21-20-23(29-28-21)36-22(27)16(11-26)25(20)15-6-4-5-7-17(15)30(24(25)32)12-19(31)35-3/h4-10H,12,27H2,1-3H3,(H,28,29)InChIKey
HJOZGPDWVCYIKI-UHFFFAOYSA-NSynonyms
COC(=O)CN1c2ccccc2C2(C1=O)C(=C(N)Oc1c2c(n(nH)1)c1cc(OC)ccc1OC)C#N
COC1=CC(=C(C=C1)OC)C2=C3C(=NN2)OC(=C(C34C5=CC=CC=C5N(C4=O)CC(=O)OC)C#N)N
InChI=1SC25H21N5O6c133138918(342)14(1013)212023(292821)3622(27)16(1126)25(20)15645717(15)30(24(25)32)1219(31)353h410H1227H213H3(H2829)
methyl(6amino5cyano3(25dimethoxyphenyl)2oxo1Hspiro(indole34pyrano(23c)pyrazol)1(2H)yl)acetate
METHYL2(6AMINO3(25DIMETHOXYPHENYL)5CYANO11OXOSPIRO(4HPYRANO(32D)PYRAZOLE43INDOLINE)10YL)ACETATE
METHYL2(6AMINO5CYANO3(25DIMETHOXYPHENYL)2OXOSPIRO(2HPYRANO(23C)PYRAZOLE43INDOLE)1YL)ACETATE
MFCD03035574
ZINC000008925926
ZINC000008925927
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.