Vitas-M small molecule compound
1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(4-ethoxyphenyl)-N'-[(E)-(3-nitrophenyl)methylidene]-1H-1,2,3-triazole-4-carbohydrazide
Catalog ID
STL048165
SMILES CCOc1ccc(cc1)c1c(nnn1c1nonc1N)C(=O)N/N=C/c1cccc(c1)[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 C20H17N9O5 MW 463.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H17N9O5/c1-2-33-15-8-6-13(7-9-15)17-16(23-27-28(17)19-18(21)25-34-26-19)20(30)24-22-11-12-4-3-5-14(10-12)29(31)32/h3-11H,2H2,1H3,(H2,21,25)(H,24,30)/b22-11+InChIKey
DXPNYKCRBTWBMK-SSDVNMTOSA-NSynonyms
577981-73-8(E)1(4amino125oxadiazol3yl)5(4ethoxyphenyl)N(3nitrobenzylidene)1H123triazole4carbohydrazide
1(4amino125oxadiazol3yl)5(4ethoxyphenyl)N((E)(3nitrophenyl)methylidene)1H123triazole4carbohydrazide
1(4AMINO125OXADIAZOL3YL)5(4ETHOXYPHENYL)N((E)(3NITROPHENYL)METHYLIDENEAMINO)TRIAZOLE4CARBOXAMIDE
577981738
CCOC1=CC=C(C=C1)C2=C(N=NN2C3=NON=C3N)C(=O)NN=CC4=CC(=CC=C4)(N+)(=O)(O)
CCOc1ccc(cc1)c1c(nnn1c1nonc1N)C(=O)NN=Cc1cccc(c1)(N+)(=O)(O)
InChI=1SC20H17N9O5c1233158613(7915)1716(232728(17)1918(21)25342619)20(30)2422111243514(1012)29(31)32h311H2H21H3(H22125)(H2430)b2211+
MFCD04021546
ZINC000001885358
ZINC33345803
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