Vitas-M small molecule compound

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

Catalog ID
STK001813
SMILES CCCc1n[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 C17H16N4O3 MW 324.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H16N4O3/c1-2-3-11-15-14(9-4-5-12-13(6-9)23-8-22-12)10(7-18)16(19)24-17(15)21-20-11/h4-6,14H,2-3,8,19H2,1H3,(H,20,21)
InChIKey
JBRZKMSFRFPSGF-UHFFFAOYSA-N
Synonyms
315246-40-3
315246403
4HPYRAZOLO(34B)PYRAN5CARBONITRILE6AMINO4(34METHYLENEDIOXYPHENYL)3PROPYL
6AMINO4(13BENZODIOXOL5YL)3PROPYL14DIHYDROPYRANO(23C)PYRAZOLE5CARBONITRILE
6AMINO4(13BENZODIOXOL5YL)3PROPYL24DIHYDROPYRANO(23C)PYRAZOLE5CARBONITRILE
6AMINO4(2H13BENZODIOXOL5YL)3PROPYL1H4HPYRANO(23C)PYRAZOLE5CARBONITRILE
6amino4(benzo(d)(13)dioxol5yl)3propyl14dihydropyrano(23c)pyrazole5carbonitrile
CCCC1=C2C(C(=C(OC2=NN1)N)C#N)C3=CC4=C(C=C3)OCO4
CCCc1n(nH)c2c1C(c1ccc3c(c1)OCO3)C(=C(O2)N)C#N
InChI=1SC17H16N4O3c123111514(9451213(69)2382212)10(718)16(19)2417(15)212011h4614H23819H21H3(H2021)
MFCD01460407
STK001813
ZINC000007078090
ZINC000007078091

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Available files

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