Vitas-M small molecule compound

4-[(E)-{2-[(2-methylfuran-3-yl)carbonyl]hydrazinylidene}methyl]phenyl 4-iodo-1-methyl-1H-pyrazole-5-carboxylate

Catalog ID
STK050558
SMILES O=C(c1ccoc1C)N/N=C/c1ccc(cc1)OC(=O)c1c(I)cnn1C

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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 C18H15IN4O4 MW 478.25 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H15IN4O4/c1-11-14(7-8-26-11)17(24)22-20-9-12-3-5-13(6-4-12)27-18(25)16-15(19)10-21-23(16)2/h3-10H,1-2H3,(H,22,24)/b20-9+
InChIKey
XJRPNCCTOHHJRB-AWQFTUOYSA-N
Synonyms
404853-55-0
(4((E)((2METHYLFURAN3CARBONYL)HYDRAZINYLIDENE)METHYL)PHENYL)4IODO2METHYLPYRAZOLE3CARBOXYLATE
(E)4((2(2methylfuran3carbonyl)hydrazono)methyl)phenyl4iodo1methyl1Hpyrazole5carboxylate
4((E)(2((2METHYLFURAN3YL)CARBONYL)HYDRAZINYLIDENE)METHYL)PHENYL4IODO1METHYL1HPYRAZOLE5CARBOXYLATE
404853550
CC1=C(C=CO1)C(=O)NN=CC2=CC=C(C=C2)OC(=O)C3=C(C=NN3C)I
InChI=1SC18H15IN4O4c11114(782611)17(24)22209123513(6412)2718(25)1615(19)102123(16)2h310H12H3(H2224)b209+
MFCD02054718
O=C(c1ccoc1C)NN=Cc1ccc(cc1)OC(=O)c1c(I)cnn1C
STK050558
ZINC000002750120
ZINC33889376

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Available files

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