Vitas-M small molecule compound

6-amino-4-(1,3-benzodioxol-5-yl)-3-(methoxymethyl)-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile

Catalog ID
STK762348
SMILES COCc1n[nH]c2c1C(c1ccc3c(c1)OCO3)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 C16H14N4O4 MW 326.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H14N4O4/c1-21-6-10-14-13(8-2-3-11-12(4-8)23-7-22-11)9(5-17)15(18)24-16(14)20-19-10/h2-4,13H,6-7,18H2,1H3,(H,19,20)
InChIKey
PPGRDIIJTRQXQE-UHFFFAOYSA-N
Synonyms

6amino4(13benzodioxol5yl)3(methoxymethyl)14dihydropyrano(23c)pyrazole5carbonitrile
6AMINO4(13BENZODIOXOL5YL)3(METHOXYMETHYL)24DIHYDROPYRANO(23C)PYRAZOLE5CARBONITRILE
COCC1=C2C(C(=C(OC2=NN1)N)C#N)C3=CC4=C(C=C3)OCO4
COCc1n(nH)c2c1C(c1ccc3c(c1)OCO3)C(=C(O2)N)C#N
InChI=1SC16H14N4O4c1216101413(8231112(48)2372211)9(517)15(18)2416(14)201910h2413H6718H21H3(H1920)
MFCD01872821
ZINC000005686987
ZINC000005686989

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Available files

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