Vitas-M small molecule compound
6-amino-4-(3,5-di-tert-butyl-4-hydroxyphenyl)-3-(4-ethoxyphenyl)-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Catalog ID
STK792015
SMILES CCOc1ccc(cc1)c1n[nH]c2c1C(c1cc(c(c(c1)C(C)(C)C)O)C(C)(C)C)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 C29H34N4O3 MW 486.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H34N4O3/c1-8-35-18-11-9-16(10-12-18)24-23-22(19(15-30)26(31)36-27(23)33-32-24)17-13-20(28(2,3)4)25(34)21(14-17)29(5,6)7/h9-14,22,34H,8,31H2,1-7H3,(H,32,33)InChIKey
FIISZJIFLPSMFY-UHFFFAOYSA-NSynonyms
845986-77-86amino4(35ditertbutyl4hydroxyphenyl)3(4ethoxyphenyl)14dihydropyrano(23c)pyrazole5carbonitrile
6AMINO4(35DITERTBUTYL4HYDROXYPHENYL)3(4ETHOXYPHENYL)24DIHYDROPYRANO(23C)PYRAZOLE5CARBONITRILE
845986778
CCOC1=CC=C(C=C1)C2=C3C(C(=C(OC3=NN2)N)C#N)C4=CC(=C(C(=C4)C(C)(C)C)O)C(C)(C)C
CCOc1ccc(cc1)c1n(nH)c2c1C(c1cc(c(c(c1)C(C)(C)C)O)C(C)(C)C)C(=C(O2)N)C#N
InChI=1SC29H34N4O3c18351811916(101218)242322(19(1530)26(31)3627(23)333224)171320(28(23)4)25(34)21(1417)29(56)7h9142234H831H217H3(H3233)
MFCD04171459
ZINC000009357906
ZINC000009357909
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