Vitas-M small molecule compound
6-amino-4-[4-(benzyloxy)-3-bromo-5-methoxyphenyl]-3-methyl-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Catalog ID
STK061931
SMILES N#CC1=C(N)Oc2c(C1c1cc(Br)c(c(c1)OC)OCc1ccccc1)c(C)n[nH]2
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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 C22H19BrN4O3 MW 467.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H19BrN4O3/c1-12-18-19(15(10-24)21(25)30-22(18)27-26-12)14-8-16(23)20(17(9-14)28-2)29-11-13-6-4-3-5-7-13/h3-9,19H,11,25H2,1-2H3,(H,26,27)InChIKey
BQRATCUVTNDVSJ-UHFFFAOYSA-NSynonyms
6AMINO4(3BROMO5METHOXY4PHENYLMETHOXYPHENYL)3METHYL24DIHYDROPYRANO(23C)PYRAZOLE5CARBONITRILE
6AMINO4(4(BENZYLOXY)3BROMO5METHOXYPHENYL)3METHYL14DIHYDROPYRANO(23C)PYRAZOLE5CARBONITRILE
CC1=C2C(C(=C(OC2=NN1)N)C#N)C3=CC(=C(C(=C3)Br)OCC4=CC=CC=C4)OC
InChI=1SC22H19BrN4O3c1121819(15(1024)21(25)3022(18)272612)14816(23)20(17(914)282)2911136435713h3919H1125H212H3(H2627)
MFCD02631336
N#CC1=C(N)Oc2c(C1c1cc(Br)c(c(c1)OC)OCc1ccccc1)c(C)n(nH)2
STK061931
ZINC000009553609
ZINC000009554069
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