Vitas-M small molecule compound
1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(2-chloro-6-nitrophenyl)methylidene]-5-(3-methoxyphenyl)-1H-1,2,3-triazole-4-carbohydrazide
Catalog ID
STL052417
SMILES COc1cccc(c1)c1c(nnn1c1nonc1N)C(=O)N/N=C/c1c(Cl)cccc1[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 C19H14ClN9O5 MW 483.83 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H14ClN9O5/c1-33-11-5-2-4-10(8-11)16-15(23-27-28(16)18-17(21)25-34-26-18)19(30)24-22-9-12-13(20)6-3-7-14(12)29(31)32/h2-9H,1H3,(H2,21,25)(H,24,30)/b22-9+InChIKey
YKYWGDGCPZHTBA-LSFURLLWSA-NSynonyms
714931-60-9(E)1(4amino125oxadiazol3yl)N(2chloro6nitrobenzylidene)5(3methoxyphenyl)1H123triazole4carbohydrazide
1(4amino125oxadiazol3yl)N((E)(2chloro6nitrophenyl)methylidene)5(3methoxyphenyl)1H123triazole4carbohydrazide
1(4AMINO125OXADIAZOL3YL)N((E)(2CHLORO6NITROPHENYL)METHYLIDENEAMINO)5(3METHOXYPHENYL)TRIAZOLE4CARBOXAMIDE
714931609
COC1=CC=CC(=C1)C2=C(N=NN2C3=NON=C3N)C(=O)NN=CC4=C(C=CC=C4Cl)(N+)(=O)(O)
COc1cccc(c1)c1c(nnn1c1nonc1N)C(=O)NN=Cc1c(Cl)cccc1(N+)(=O)(O)
InChI=1SC19H14ClN9O5c1331152410(811)1615(232728(16)1817(21)25342618)19(30)242291213(20)63714(12)29(31)32h29H1H3(H22125)(H2430)b229+
MFCD05682696
ZINC000001896942
ZINC33345861
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