Vitas-M small molecule compound

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

Catalog ID
STL346914
SMILES O=C(c1nnn(c1c1ccc2c(c1)OCO2)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 C17H12N8O4S MW 424.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H12N8O4S/c18-15-16(23-29-22-15)25-14(10-1-2-11-12(5-10)28-8-27-11)13(20-24-25)17(26)21-19-6-9-3-4-30-7-9/h1-7H,8H2,(H2,18,22)(H,21,26)/b19-6+
InChIKey
MMXLNIMZIOWJRE-KPSZGOFPSA-N
Synonyms
849000-14-2
(E)1(4amino125oxadiazol3yl)5(benzo(d)(13)dioxol5yl)N(thiophen3ylmethylene)1H123triazole4carbohydrazide
1(4amino125oxadiazol3yl)5(13benzodioxol5yl)N((E)thiophen3ylmethylidene)1H123triazole4carbohydrazide
1(4AMINO125OXADIAZOL3YL)5(13BENZODIOXOL5YL)N((E)THIOPHEN3YLMETHYLIDENEAMINO)TRIAZOLE4CARBOXAMIDE
849000142
C1OC2=C(O1)C=C(C=C2)C3=C(N=NN3C4=NON=C4N)C(=O)NN=CC5=CSC=C5
InChI=1SC17H12N8O4Sc181516(23292215)2514(10121112(510)2882711)13(202425)17(26)211969343079h17H8H2(H21822)(H2126)b196+
MFCD05679789
O=C(c1nnn(c1c1ccc2c(c1)OCO2)c1nonc1N)NN=Cc1cscc1
ZINC000002448862
ZINC33372753

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Available files

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