Vitas-M small molecule compound

ethyl 4-(6-amino-5-cyano-3-methyl-1,4-dihydropyrano[2,3-c]pyrazol-4-yl)-3,5-dimethyl-1H-pyrrole-2-carboxylate

Catalog ID
STK678043
SMILES CCOC(=O)c1[nH]c(c(c1C)C1C(=C(N)Oc2c1c(C)n[nH]2)C#N)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 C17H19N5O3 MW 341.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H19N5O3/c1-5-24-17(23)14-7(2)11(8(3)20-14)13-10(6-18)15(19)25-16-12(13)9(4)21-22-16/h13,20H,5,19H2,1-4H3,(H,21,22)
InChIKey
CZRGLEKSNOJUMU-UHFFFAOYSA-N
Synonyms

CCOC(=O)c1(nH)c(c(c1C)C1C(=C(N)Oc2c1c(C)n(nH)2)C#N)C
CCOC(=O)C1=C(C(=C(N1)C)C2C(=C(OC3=NNC(=C23)C)N)C#N)C
ETHYL4(6AMINO5CYANO3METHYL(4HPYRANO(32D)PYRAZOL4YL))35DIMETHYLPYRROLE2CARBOXYLATE
ethyl4(6amino5cyano3methyl14dihydropyrano(23c)pyrazol4yl)35dimethyl1Hpyrrole2carboxylate
ETHYL4(6AMINO5CYANO3METHYL24DIHYDROPYRANO(23C)PYRAZOL4YL)35DIMETHYL1HPYRROLE2CARBOXYLATE
InChI=1SC17H19N5O3c152417(23)147(2)11(8(3)2014)1310(618)15(19)251612(13)9(4)212216h1320H519H214H3(H2122)
MFCD03036251
ZINC000006024569
ZINC000006024570

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Available files

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