Vitas-M small molecule compound

4-(6-amino-3-tert-butyl-5-cyano-1,4-dihydropyrano[2,3-c]pyrazol-4-yl)-2-methoxyphenyl morpholine-4-carboxylate

Catalog ID
STK763053
SMILES N#CC1=C(N)Oc2c(C1c1ccc(c(c1)OC)OC(=O)N1CCOCC1)c(n[nH]2)C(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 C23H27N5O5 MW 453.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H27N5O5/c1-23(2,3)19-18-17(14(12-24)20(25)33-21(18)27-26-19)13-5-6-15(16(11-13)30-4)32-22(29)28-7-9-31-10-8-28/h5-6,11,17H,7-10,25H2,1-4H3,(H,26,27)
InChIKey
OTBIFBOVVCRZBJ-UHFFFAOYSA-N
Synonyms

(4(6AMINO3TERTBUTYL5CYANO24DIHYDROPYRANO(23C)PYRAZOL4YL)2METHOXYPHENYL)MORPHOLINE4CARBOXYLATE
4(6AMINO3(TERTBUTYL)5CYANO(4HPYRANO(32D)PYRAZOL4YL))2METHOXYPHENYLMORPHOLINE4CARBOXYLATE
4(6amino3tertbutyl5cyano14dihydropyrano(23c)pyrazol4yl)2methoxyphenylmorpholine4carboxylate
4(6AMINO3TERTBUTYL5CYANO24DIHYDROPYRANO(23C)PYRAZOL4YL)2METHOXYPHENYLMORPHOLINE4CARBOXYLATE
CC(C)(C)C1=C2C(C(=C(OC2=NN1)N)C#N)C3=CC(=C(C=C3)OC(=O)N4CCOCC4)OC
InChI=1SC23H27N5O5c123(23)191817(14(1224)20(25)3321(18)272619)135615(16(1113)304)3222(29)28793110828h561117H71025H214H3(H2627)
MFCD02110905
N#CC1=C(N)Oc2c(C1c1ccc(c(c1)OC)OC(=O)N1CCOCC1)c(n(nH)2)C(C)(C)C
ZINC000000709683
ZINC000000709684

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.