Vitas-M small molecule compound
N'-{(E)-[2-(4-ethoxyphenyl)-4-(4-fluorophenyl)-4H-chromen-3-yl]methylidene}-5-nitrofuran-2-carbohydrazide
Catalog ID
STK700604
SMILES CCOc1ccc(cc1)C1=C(/C=N/NC(=O)c2ccc(o2)[N+](=O)[O-])C(c2c(O1)cccc2)c1ccc(cc1)F
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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 C29H22FN3O6 MW 527.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H22FN3O6/c1-2-37-21-13-9-19(10-14-21)28-23(17-31-32-29(34)25-15-16-26(38-25)33(35)36)27(18-7-11-20(30)12-8-18)22-5-3-4-6-24(22)39-28/h3-17,27H,2H2,1H3,(H,32,34)/b31-17+InChIKey
AWYOQFKCQRKCSA-KBVAKVRCSA-NSynonyms
(E)N((2(4ethoxyphenyl)4(4fluorophenyl)4Hchromen3yl)methylene)5nitrofuran2carbohydrazide
CCOC1=CC=C(C=C1)C2=C(C(C3=CC=CC=C3O2)C4=CC=C(C=C4)F)C=NNC(=O)C5=CC=C(O5)(N+)(=O)(O)
CCOc1ccc(cc1)C1=C(C=NNC(=O)c2ccc(o2)(N+)(=O)(O))C(c2c(O1)cccc2)c1ccc(cc1)F
InChI=1SC29H22FN3O6c12372113919(101421)2823(17313229(34)25151626(3825)33(35)36)27(1871120(30)12818)22534624(22)3928h31727H2H21H3(H3234)b3117+
MFCD01852221
N((E)(2(4ethoxyphenyl)4(4fluorophenyl)4Hchromen3yl)methylidene)5nitrofuran2carbohydrazide
N((E)(2(4ethoxyphenyl)4(4fluorophenyl)4Hchromen3yl)methylideneamino)5nitrofuran2carboxamide
ZINC000001831297
ZINC000100239262
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