Vitas-M small molecule compound
6-amino-4-{3-bromo-4-[(4-chlorobenzyl)oxy]-5-methoxyphenyl}-3-methyl-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Catalog ID
STK788645
SMILES N#CC1=C(N)Oc2c(C1c1cc(Br)c(c(c1)OC)OCc1ccc(cc1)Cl)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 C22H18BrClN4O3 MW 501.77 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H18BrClN4O3/c1-11-18-19(15(9-25)21(26)31-22(18)28-27-11)13-7-16(23)20(17(8-13)29-2)30-10-12-3-5-14(24)6-4-12/h3-8,19H,10,26H2,1-2H3,(H,27,28)InChIKey
HBZMQZDNVDFBMA-UHFFFAOYSA-NSynonyms
488843-66-9488843669
6amino4(3bromo4((4chlorobenzyl)oxy)5methoxyphenyl)3methyl14dihydropyrano(23c)pyrazole5carbonitrile
6AMINO4(3BROMO4((4CHLOROPHENYL)METHOXY)5METHOXYPHENYL)3METHYL24DIHYDROPYRANO(23C)PYRAZOLE5CARBONITRILE
CC1=C2C(C(=C(OC2=NN1)N)C#N)C3=CC(=C(C(=C3)Br)OCC4=CC=C(C=C4)Cl)OC
InChI=1SC22H18BrClN4O3c1111819(15(925)21(26)3122(18)282711)13716(23)20(17(813)292)3010123514(24)6412h3819H1026H212H3(H2728)
MFCD03294528
N#CC1=C(N)Oc2c(C1c1cc(Br)c(c(c1)OC)OCc1ccc(cc1)Cl)c(C)n(nH)2
ZINC000009272318
ZINC000009331731
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