Vitas-M small molecule compound

1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-bicyclo[2.2.1]hept-5-en-2-ylmethylidene]-5-(4-nitrophenyl)-1H-1,2,3-triazole-4-carbohydrazide

Catalog ID
STK568121
SMILES O=C(c1nnn(c1c1ccc(cc1)[N+](=O)[O-])c1nonc1N)N/N=C/C1CC2CC1C=C2

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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 C19H17N9O4 MW 435.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H17N9O4/c20-17-18(25-32-24-17)27-16(11-3-5-14(6-4-11)28(30)31)15(22-26-27)19(29)23-21-9-13-8-10-1-2-12(13)7-10/h1-6,9-10,12-13H,7-8H2,(H2,20,24)(H,23,29)/b21-9+
InChIKey
FLHQCOUOQOKTQB-ZVBGSRNCSA-N
Synonyms
1192740-19-4
(E)1(4amino125oxadiazol3yl)N((1S4S)bicyclo(221)hept5en2ylmethylene)5(4nitrophenyl)1H123triazole4carbohydrazide
1(4amino125oxadiazol3yl)N((E)5bicyclo(221)hept2enylmethylideneamino)5(4nitrophenyl)triazole4carboxamide
1(4amino125oxadiazol3yl)N((E)bicyclo(221)hept5en2ylmethylidene)5(4nitrophenyl)1H123triazole4carbohydrazide
1192740194
C1C2CC(C1C=C2)C=NNC(=O)C3=C(N(N=N3)C4=NON=C4N)C5=CC=C(C=C5)(N+)(=O)(O)
InChI=1SC19H17N9O4c201718(25322417)2716(113514(6411)28(30)31)15(222627)19(29)23219138101212(13)710h169101213H78H2(H22024)(H2329)b219+
MFCD03171351
O=C(c1nnn(c1c1ccc(cc1)(N+)(=O)(O))c1nonc1N)NN=CC1CC2CC1C=C2
ZINC000101067606
ZINC000101067610

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Available files

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