Vitas-M small molecule compound
methyl 5-[(2-{(1Z)-1-[2-({5-[(4-nitrophenoxy)methyl]furan-2-yl}carbonyl)hydrazinylidene]ethyl}phenoxy)methyl]furan-2-carboxylate
Catalog ID
STL176199
SMILES COC(=O)c1ccc(o1)COc1ccccc1/C(=N\NC(=O)c1ccc(o1)COc1ccc(cc1)[N+](=O)[O-])/C
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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 C27H23N3O9 MW 533.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H23N3O9/c1-17(22-5-3-4-6-23(22)37-16-21-12-14-25(39-21)27(32)35-2)28-29-26(31)24-13-11-20(38-24)15-36-19-9-7-18(8-10-19)30(33)34/h3-14H,15-16H2,1-2H3,(H,29,31)/b28-17-InChIKey
DIIGDBBOUULVEN-QRQIAZFYSA-NSynonyms
828296-06-6828296066
CC(=NNC(=O)C1=CC=C(O1)COC2=CC=C(C=C2)(N+)(=O)(O))C3=CC=CC=C3OCC4=CC=C(O4)C(=O)OC
COC(=O)c1ccc(o1)COc1ccccc1C(=NNC(=O)c1ccc(o1)COc1ccc(cc1)(N+)(=O)(O))C
InChI=1SC27H23N3O9c117(22534623(22)371621121425(3921)27(32)352)282926(31)24131120(3824)1536199718(81019)30(33)34h314H1516H212H3(H2931)b2817
methyl5((2((1Z)1(2((5((4nitrophenoxy)methyl)furan2yl)carbonyl)hydrazinylidene)ethyl)phenoxy)methyl)furan2carboxylate
METHYL5((2((1Z)1METHYL2((5((4NITROPHENOXY)METHYL)(2FURYL))CARBONYLAMINO)2AZAVINYL)PHENOXY)METHYL)FURAN2CARBOXYLATE
METHYL5((2((Z)CMETHYLN((5((4NITROPHENOXY)METHYL)FURAN2CARBONYL)AMINO)CARBONIMIDOYL)PHENOXY)METHYL)FURAN2CARBOXYLATE
MFCD06195407
ZINC000102441526
ZINC103256979
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