Vitas-M small molecule compound
methyl 3-(2,6-dichlorophenyl)-5-[1-(4-nitrophenyl)-1H-1,2,3-triazol-4-yl]-1,2-oxazole-4-carboxylate
Catalog ID
STL442407
SMILES COC(=O)c1c(onc1c1c(Cl)cccc1Cl)c1nnn(c1)c1ccc(cc1)[N+](=O)[O-]
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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 C19H11Cl2N5O5 MW 460.23 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H11Cl2N5O5/c1-30-19(27)16-17(15-12(20)3-2-4-13(15)21)23-31-18(16)14-9-25(24-22-14)10-5-7-11(8-6-10)26(28)29/h2-9H,1H3InChIKey
CADIJTHMWDIOPX-UHFFFAOYSA-NSynonyms
COC(=O)C1=C(ON=C1C2=C(C=CC=C2Cl)Cl)C3=CN(N=N3)C4=CC=C(C=C4)(N+)(=O)(O)
COC(=O)c1c(onc1c1c(Cl)cccc1Cl)c1nnn(c1)c1ccc(cc1)(N+)(=O)(O)
InChI=1SC19H11Cl2N5O5c13019(27)1617(1512(20)32413(15)21)233118(16)14925(242214)105711(8610)26(28)29h29H1H3
methyl3(26dichlorophenyl)5(1(4nitrophenyl)1H123triazol4yl)12oxazole4carboxylate
METHYL3(26DICHLOROPHENYL)5(1(4NITROPHENYL)1H123TRIAZOL4YL)ISOXAZOLE4CARBOXYLATE
methyl3(26dichlorophenyl)5(1(4nitrophenyl)triazol4yl)12oxazole4carboxylate
MFCD23700911
ZINC000095079685
ZINC95079685
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