Vitas-M small molecule compound

1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-cyclohexylmethylidene]-5-(3-nitrophenyl)-1H-1,2,3-triazole-4-carbohydrazide

Catalog ID
STK552358
SMILES O=C(c1nnn(c1c1cccc(c1)[N+](=O)[O-])c1nonc1N)N/N=C/C1CCCCC1

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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 C18H19N9O4 MW 425.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H19N9O4/c19-16-17(24-31-23-16)26-15(12-7-4-8-13(9-12)27(29)30)14(21-25-26)18(28)22-20-10-11-5-2-1-3-6-11/h4,7-11H,1-3,5-6H2,(H2,19,23)(H,22,28)/b20-10+
InChIKey
NQXZFHGUKLPYFM-KEBDBYFISA-N
Synonyms
799833-12-8
(E)1(4amino125oxadiazol3yl)N(cyclohexylmethylene)5(3nitrophenyl)1H123triazole4carbohydrazide
1(4amino125oxadiazol3yl)N((E)cyclohexylmethylidene)5(3nitrophenyl)1H123triazole4carbohydrazide
1(4amino125oxadiazol3yl)N((E)cyclohexylmethylideneamino)5(3nitrophenyl)triazole4carboxamide
799833128
C1CCC(CC1)C=NNC(=O)C2=C(N(N=N2)C3=NON=C3N)C4=CC(=CC=C4)(N+)(=O)(O)
InChI=1SC18H19N9O4c191617(24312316)2615(1274813(912)27(29)30)14(212526)18(28)222010115213611h4711H1356H2(H21923)(H2228)b2010+
MFCD03339009
O=C(c1nnn(c1c1cccc(c1)(N+)(=O)(O))c1nonc1N)NN=CC1CCCCC1
ZINC000009348289
ZINC33563820

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Available files

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