Vitas-M small molecule compound
6-amino-4-{3-[(4-bromo-2-chlorophenoxy)methyl]-4-methoxyphenyl}-3-methyl-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Catalog ID
STK317651
SMILES N#CC1=C(N)Oc2c(C1c1ccc(c(c1)COc1ccc(cc1Cl)Br)OC)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/c1-11-19-20(15(9-25)21(26)31-22(19)28-27-11)12-3-5-17(29-2)13(7-12)10-30-18-6-4-14(23)8-16(18)24/h3-8,20H,10,26H2,1-2H3,(H,27,28)InChIKey
NDEWZHUGTOYHSW-UHFFFAOYSA-NSynonyms
445239-42-9445239429
6amino4(3((4bromo2chlorophenoxy)methyl)4methoxyphenyl)3methyl14dihydropyrano(23c)pyrazole5carbonitrile
6AMINO4(3((4BROMO2CHLOROPHENOXY)METHYL)4METHOXYPHENYL)3METHYL24DIHYDROPYRANO(23C)PYRAZOLE5CARBONITRILE
CC1=C2C(C(=C(OC2=NN1)N)C#N)C3=CC(=C(C=C3)OC)COC4=C(C=C(C=C4)Br)Cl
InChI=1SC22H18BrClN4O3c1111920(15(925)21(26)3122(19)282711)123517(292)13(712)1030186414(23)816(18)24h3820H1026H212H3(H2728)
MFCD02374281
N#CC1=C(N)Oc2c(C1c1ccc(c(c1)COc1ccc(cc1Cl)Br)OC)c(C)n(nH)2
ZINC000000650002
ZINC000000650005
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