Vitas-M small molecule compound
1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-1,3-benzodioxol-5-ylmethylidene]-5-propyl-1H-1,2,3-triazole-4-carbohydrazide
Catalog ID
STL006262
SMILES CCCc1c(nnn1c1nonc1N)C(=O)N/N=C/c1ccc2c(c1)OCO2
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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 C16H16N8O4 MW 384.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H16N8O4/c1-2-3-10-13(19-23-24(10)15-14(17)21-28-22-15)16(25)20-18-7-9-4-5-11-12(6-9)27-8-26-11/h4-7H,2-3,8H2,1H3,(H2,17,21)(H,20,25)/b18-7+InChIKey
DALYCHUPFPFRLW-CNHKJKLMSA-NSynonyms
848987-60-0(E)1(4amino125oxadiazol3yl)N(benzo(d)(13)dioxol5ylmethylene)5propyl1H123triazole4carbohydrazide
1(4amino125oxadiazol3yl)N((E)13benzodioxol5ylmethylidene)5propyl1H123triazole4carbohydrazide
1(4AMINO125OXADIAZOL3YL)N((E)13BENZODIOXOL5YLMETHYLIDENEAMINO)5PROPYLTRIAZOLE4CARBOXAMIDE
848987600
CCCC1=C(N=NN1C2=NON=C2N)C(=O)NN=CC3=CC4=C(C=C3)OCO4
CCCc1c(nnn1c1nonc1N)C(=O)NN=Cc1ccc2c(c1)OCO2
InChI=1SC16H16N8O4c1231013(192324(10)1514(17)21282215)16(25)201879451112(69)2782611h47H238H21H3(H21721)(H2025)b187+
MFCD03171114
ZINC000002446210
ZINC33372616
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