Vitas-M small molecule compound
2-methoxy-4-[(E)-{2-[(5-phenyl-2H-tetrazol-2-yl)acetyl]hydrazinylidene}methyl]phenyl 2-chloro-4,5-difluorobenzoate
Catalog ID
STL368048
SMILES COc1cc(/C=N/NC(=O)Cn2nnc(n2)c2ccccc2)ccc1OC(=O)c1cc(F)c(cc1Cl)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 C24H17ClF2N6O4 MW 526.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H17ClF2N6O4/c1-36-21-9-14(7-8-20(21)37-24(35)16-10-18(26)19(27)11-17(16)25)12-28-29-22(34)13-33-31-23(30-32-33)15-5-3-2-4-6-15/h2-12H,13H2,1H3,(H,29,34)/b28-12+InChIKey
HAHRMEAWLXYDSM-KVSWJAHQSA-NSynonyms
(2METHOXY4((E)((2(5PHENYLTETRAZOL2YL)ACETYL)HYDRAZINYLIDENE)METHYL)PHENYL)2CHLORO45DIFLUOROBENZOATE
2methoxy4((E)(2((5phenyl2Htetrazol2yl)acetyl)hydrazinylidene)methyl)phenyl2chloro45difluorobenzoate
COC1=C(C=CC(=C1)C=NNC(=O)CN2N=C(N=N2)C3=CC=CC=C3)OC(=O)C4=CC(=C(C=C4Cl)F)F
COc1cc(C=NNC(=O)Cn2nnc(n2)c2ccccc2)ccc1OC(=O)c1cc(F)c(cc1Cl)F
InChI=1SC24H17ClF2N6O4c13621914(7820(21)3724(35)161018(26)19(27)1117(16)25)12282922(34)13333123(303233)155324615h212H13H21H3(H2934)b2812+
MFCD01330397
ZINC000001191478
ZINC100498709
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