Vitas-M small molecule compound
4-[6-amino-5-cyano-3-(3-nitrophenyl)-1,4-dihydropyrano[2,3-c]pyrazol-4-yl]-2,6-dimethoxyphenyl morpholine-4-carboxylate
Catalog ID
STK676720
SMILES N#CC1=C(N)Oc2c(C1c1cc(OC)c(c(c1)OC)OC(=O)N1CCOCC1)c(n[nH]2)c1cccc(c1)[N+](=O)[O-]
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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 C26H24N6O8 MW 548.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H24N6O8/c1-36-18-11-15(12-19(37-2)23(18)39-26(33)31-6-8-38-9-7-31)20-17(13-27)24(28)40-25-21(20)22(29-30-25)14-4-3-5-16(10-14)32(34)35/h3-5,10-12,20H,6-9,28H2,1-2H3,(H,29,30)InChIKey
PXBCDUKHBZOGPE-UHFFFAOYSA-NSynonyms
(4(6AMINO5CYANO3(3NITROPHENYL)24DIHYDROPYRANO(23C)PYRAZOL4YL)26DIMETHOXYPHENYL)MORPHOLINE4CARBOXYLATE
4(6AMINO5CYANO3(3NITROPHENYL)(4HPYRANO(32D)PYRAZOL4YL))26DIMETHOXYPHENYLMORPHOLINE4CARBOXYLATE
4(6amino5cyano3(3nitrophenyl)14dihydropyrano(23c)pyrazol4yl)26dimethoxyphenylmorpholine4carboxylate
COC1=CC(=CC(=C1OC(=O)N2CCOCC2)OC)C3C(=C(OC4=NNC(=C34)C5=CC(=CC=C5)(N+)(=O)(O))N)C#N
InChI=1SC26H24N6O8c136181115(1219(372)23(18)3926(33)3168389731)2017(1327)24(28)402521(20)22(293025)1443516(1014)32(34)35h35101220H6928H212H3(H2930)
MFCD01971965
N#CC1=C(N)Oc2c(C1c1cc(OC)c(c(c1)OC)OC(=O)N1CCOCC1)c(n(nH)2)c1cccc(c1)(N+)(=O)(O)
ZINC000098003566
ZINC000098003567
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.