Vitas-M small molecule compound

6-amino-3-tert-butyl-4-(4-tert-butylphenyl)-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile

Catalog ID
STK846415
SMILES N#CC1=C(N)Oc2c(C1c1ccc(cc1)C(C)(C)C)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 C21H26N4O MW 350.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H26N4O/c1-20(2,3)13-9-7-12(8-10-13)15-14(11-22)18(23)26-19-16(15)17(24-25-19)21(4,5)6/h7-10,15H,23H2,1-6H3,(H,24,25)
InChIKey
YVJUSFRZLQXENV-UHFFFAOYSA-N
Synonyms
369399-33-7
369399337
6AMINO3(11DIMETHYLETHYL)4(4(11DIMETHYLETHYL)PHENYL)24DIHYDROPYRANO(23C)PYRAZOLE5CARBONITRILE
6amino3(tertbutyl)4(4(tertbutyl)phenyl)24dihydropyrano(23c)pyrazole5carbonitrile
6AMINO3(TERTBUTYL)4(4(TERTBUTYL)PHENYL)4HPYRANO(23C)PYRAZOLE5CARBONITRILE
6amino3tertbutyl4(4tertbutylphenyl)14dihydropyrano(23c)pyrazole5carbonitrile
6AMINO3TERTBUTYL4(4TERTBUTYLPHENYL)24DIHYDROPYRANO(23C)PYRAZOLE5CARBONITRILE
CC(C)(C)C1=CC=C(C=C1)C2C(=C(OC3=NNC(=C23)C(C)(C)C)N)C#N
InChI=1SC21H26N4Oc120(23)139712(81013)1514(1122)18(23)261916(15)17(242519)21(45)6h71015H23H216H3(H2425)
MFCD03172978
N#CC1=C(N)Oc2c(C1c1ccc(cc1)C(C)(C)C)c((nH)n2)C(C)(C)C
N#CC1=C(N)Oc2c(C1c1ccc(cc1)C(C)(C)C)c(n(nH)2)C(C)(C)C
ZINC000004426997
ZINC000004427000

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Available files

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