Vitas-M small molecule compound

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

Catalog ID
STL057526
SMILES O=C(c1nnn(c1c1ccc(cc1)[N+](=O)[O-])c1nonc1N)N/N=C/c1cscc1

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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 C16H11N9O4S MW 425.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H11N9O4S/c17-14-15(22-29-21-14)24-13(10-1-3-11(4-2-10)25(27)28)12(19-23-24)16(26)20-18-7-9-5-6-30-8-9/h1-8H,(H2,17,21)(H,20,26)/b18-7+
InChIKey
XBZHGYHUZUJUEB-CNHKJKLMSA-N
Synonyms
714933-42-3
(E)1(4amino125oxadiazol3yl)5(4nitrophenyl)N(thiophen3ylmethylene)1H123triazole4carbohydrazide
1(4amino125oxadiazol3yl)5(4nitrophenyl)N((E)thiophen3ylmethylidene)1H123triazole4carbohydrazide
1(4AMINO125OXADIAZOL3YL)5(4NITROPHENYL)N((E)THIOPHEN3YLMETHYLIDENEAMINO)TRIAZOLE4CARBOXAMIDE
714933423
C1=CC(=CC=C1C2=C(N=NN2C3=NON=C3N)C(=O)NN=CC4=CSC=C4)(N+)(=O)(O)
InChI=1SC16H11N9O4Sc171415(22292114)2413(101311(4210)25(27)28)12(192324)16(26)201879563089h18H(H21721)(H2026)b187+
MFCD04011618
O=C(c1nnn(c1c1ccc(cc1)(N+)(=O)(O))c1nonc1N)NN=Cc1cscc1
ZINC000001897204
ZINC33345863

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Available files

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