Vitas-M small molecule compound
6-amino-4-(3-bromo-5-ethoxy-4-hydroxyphenyl)-3-(4-ethoxyphenyl)-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Catalog ID
STL071179
SMILES CCOc1ccc(cc1)c1n[nH]c2c1C(c1cc(Br)c(c(c1)OCC)O)C(=C(O2)N)C#N
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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 C23H21BrN4O4 MW 497.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H21BrN4O4/c1-3-30-14-7-5-12(6-8-14)20-19-18(15(11-25)22(26)32-23(19)28-27-20)13-9-16(24)21(29)17(10-13)31-4-2/h5-10,18,29H,3-4,26H2,1-2H3,(H,27,28)InChIKey
TZMMVVXHYDHHKJ-UHFFFAOYSA-NSynonyms
845990-83-26amino4(3bromo5ethoxy4hydroxyphenyl)3(4ethoxyphenyl)14dihydropyrano(23c)pyrazole5carbonitrile
6AMINO4(3BROMO5ETHOXY4HYDROXYPHENYL)3(4ETHOXYPHENYL)24DIHYDROPYRANO(23C)PYRAZOLE5CARBONITRILE
845990832
CCOC1=CC=C(C=C1)C2=C3C(C(=C(OC3=NN2)N)C#N)C4=CC(=C(C(=C4)Br)O)OCC
CCOc1ccc(cc1)c1n(nH)c2c1C(c1cc(Br)c(c(c1)OCC)O)C(=C(O2)N)C#N
InChI=1SC23H21BrN4O4c1330147512(6814)201918(15(1125)22(26)3223(19)282720)13916(24)21(29)17(1013)3142h5101829H3426H212H3(H2728)
MFCD04171769
ZINC000009282263
ZINC000009282264
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