Vitas-M small molecule compound
6-amino-4-(4-butoxy-3-methoxyphenyl)-3-tert-butyl-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Catalog ID
STL149821
SMILES CCCCOc1ccc(cc1OC)C1C(=C(N)Oc2c1c(n[nH]2)C(C)(C)C)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 C22H28N4O3 MW 396.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H28N4O3/c1-6-7-10-28-15-9-8-13(11-16(15)27-5)17-14(12-23)20(24)29-21-18(17)19(25-26-21)22(2,3)4/h8-9,11,17H,6-7,10,24H2,1-5H3,(H,25,26)InChIKey
XWXBGSSLNLVLKF-UHFFFAOYSA-NSynonyms
384367-07-1384367071
6amino4(4butoxy3methoxyphenyl)3(tertbutyl)24dihydropyrano(23c)pyrazole5carbonitrile
6amino4(4butoxy3methoxyphenyl)3tertbutyl14dihydropyrano(23c)pyrazole5carbonitrile
6AMINO4(4BUTOXY3METHOXYPHENYL)3TERTBUTYL24DIHYDROPYRANO(23C)PYRAZOLE5CARBONITRILE
CCCCOC1=C(C=C(C=C1)C2C(=C(OC3=NNC(=C23)C(C)(C)C)N)C#N)OC
CCCCOc1ccc(cc1OC)C1C(=C(N)Oc2c1c((nH)n2)C(C)(C)C)C#N
CCCCOc1ccc(cc1OC)C1C(=C(N)Oc2c1c(n(nH)2)C(C)(C)C)C#N
InChI=1SC22H28N4O3c1671028159813(1116(15)275)1714(1223)20(24)292118(17)19(252621)22(23)4h891117H671024H215H3(H2526)
MFCD03809487
ZINC000009046739
ZINC000009177100
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