Vitas-M small molecule compound
6-amino-4-{2-[(4-bromobenzyl)oxy]-3-methoxyphenyl}-3-methyl-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Catalog ID
STK061373
SMILES N#CC1=C(N)Oc2c(C1c1cccc(c1OCc1ccc(cc1)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 C22H19BrN4O3 MW 467.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H19BrN4O3/c1-12-18-19(16(10-24)21(25)30-22(18)27-26-12)15-4-3-5-17(28-2)20(15)29-11-13-6-8-14(23)9-7-13/h3-9,19H,11,25H2,1-2H3,(H,26,27)InChIKey
NCTVPXVCWWGHJA-UHFFFAOYSA-NSynonyms
421573-68-4421573684
6AMINO4(2((4BROMOBENZYL)OXY)3METHOXYPHENYL)3METHYL14DIHYDROPYRANO(23C)PYRAZOLE5CARBONITRILE
6AMINO4(2((4BROMOPHENYL)METHOXY)3METHOXYPHENYL)3METHYL24DIHYDROPYRANO(23C)PYRAZOLE5CARBONITRILE
CC1=C2C(C(=C(OC2=NN1)N)C#N)C3=C(C(=CC=C3)OC)OCC4=CC=C(C=C4)Br
InChI=1SC22H19BrN4O3c1121819(16(1024)21(25)3022(18)272612)1543517(282)20(15)2911136814(23)9713h3919H1125H212H3(H2627)
MFCD02631359
N#CC1=C(N)Oc2c(C1c1cccc(c1OCc1ccc(cc1)Br)OC)c(C)n(nH)2
STK061373
ZINC000018116108
ZINC000018116111
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