Vitas-M small molecule compound
1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(2,6-dimethoxyphenyl)carbonyl]-5-(4-nitrophenyl)-1H-1,2,3-triazole-4-carbohydrazide
Catalog ID
STL356301
SMILES COc1cccc(c1C(=O)NNC(=O)c1nnn(c1c1ccc(cc1)[N+](=O)[O-])c1nonc1N)OC
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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 C20H17N9O7 MW 495.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H17N9O7/c1-34-12-4-3-5-13(35-2)14(12)19(30)23-24-20(31)15-16(10-6-8-11(9-7-10)29(32)33)28(27-22-15)18-17(21)25-36-26-18/h3-9H,1-2H3,(H2,21,25)(H,23,30)(H,24,31)InChIKey
DYGWWINHNDDJLR-UHFFFAOYSA-NSynonyms
364382-59-21(4amino125oxadiazol3yl)N((26dimethoxyphenyl)carbonyl)5(4nitrophenyl)1H123triazole4carbohydrazide
1(4amino125oxadiazol3yl)N(26dimethoxybenzoyl)5(4nitrophenyl)1H123triazole4carbohydrazide
1(4AMINO125OXADIAZOL3YL)N(26DIMETHOXYBENZOYL)5(4NITROPHENYL)TRIAZOLE4CARBOHYDRAZIDE
364382592
COC1=C(C(=CC=C1)OC)C(=O)NNC(=O)C2=C(N(N=N2)C3=NON=C3N)C4=CC=C(C=C4)(N+)(=O)(O)
COc1cccc(c1C(=O)NNC(=O)c1nnn(c1c1ccc(cc1)(N+)(=O)(O))c1nonc1N)OC
InChI=1SC20H17N9O7c1341243513(352)14(12)19(30)232420(31)1516(106811(9710)29(32)33)28(272215)1817(21)25362618h39H12H3(H22125)(H2330)(H2431)
MFCD02102932
ZINC000002331243
ZINC02331243
ZINC2331243
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