Vitas-M small molecule compound
6-amino-4-{3-[(3-chloro-4-fluorophenoxy)methyl]-4-methoxyphenyl}-3-methyl-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Catalog ID
STL391288
SMILES N#CC1=C(N)Oc2c(C1c1ccc(c(c1)COc1ccc(c(c1)Cl)F)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 C22H18ClFN4O3 MW 440.86 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H18ClFN4O3/c1-11-19-20(15(9-25)21(26)31-22(19)28-27-11)12-3-6-18(29-2)13(7-12)10-30-14-4-5-17(24)16(23)8-14/h3-8,20H,10,26H2,1-2H3,(H,27,28)InChIKey
XPADHLJVGYOOBY-UHFFFAOYSA-NSynonyms
445036-98-6445036986
6amino4(3((3chloro4fluorophenoxy)methyl)4methoxyphenyl)3methyl14dihydropyrano(23c)pyrazole5carbonitrile
6amino4(3((3chloro4fluorophenoxy)methyl)4methoxyphenyl)3methyl24dihydropyrano(23c)pyrazole5carbonitrile
CC1=C2C(C(=C(OC2=NN1)N)C#N)C3=CC(=C(C=C3)OC)COC4=CC(=C(C=C4)F)Cl
InChI=1SC22H18ClFN4O3c1111920(15(925)21(26)3122(19)282711)123618(292)13(712)1030144517(24)16(23)814h3820H1026H212H3(H2728)
MFCD02243608
N#CC1=C(N)Oc2c(C1c1ccc(c(c1)COc1ccc(c(c1)Cl)F)OC)c(C)n(nH)2
ZINC000002769447
ZINC000002769448
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