Vitas-M small molecule compound
2-({[1-(4-amino-1,2,5-oxadiazol-3-yl)-4-{[(2E)-2-(2-methoxybenzylidene)hydrazinyl]carbonyl}-1H-1,2,3-triazol-5-yl]methyl}amino)benzamide
Catalog ID
STL004961
SMILES COc1ccccc1/C=N/NC(=O)c1nnn(c1CNc1ccccc1C(=O)N)c1nonc1N
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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 C21H20N10O4 MW 476.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20N10O4/c1-34-16-9-5-2-6-12(16)10-25-27-21(33)17-15(31(30-26-17)20-18(22)28-35-29-20)11-24-14-8-4-3-7-13(14)19(23)32/h2-10,24H,11H2,1H3,(H2,22,28)(H2,23,32)(H,27,33)/b25-10+InChIKey
MBOBWPZQASZQKF-KIBLKLHPSA-NSynonyms
849825-55-4(E)2(((1(4amino125oxadiazol3yl)4(2(2methoxybenzylidene)hydrazinecarbonyl)1H123triazol5yl)methyl)amino)benzamide
1(4amino125oxadiazol3yl)5((2carbamoylanilino)methyl)N((E)(2methoxyphenyl)methylideneamino)triazole4carboxamide
2(((1(4amino125oxadiazol3yl)4(((2E)2(2methoxybenzylidene)hydrazinyl)carbonyl)1H123triazol5yl)methyl)amino)benzamide
849825554
COC1=CC=CC=C1C=NNC(=O)C2=C(N(N=N2)C3=NON=C3N)CNC4=CC=CC=C4C(=O)N
COc1ccccc1C=NNC(=O)c1nnn(c1CNc1ccccc1C(=O)N)c1nonc1N
InChI=1SC21H20N10O4c13416952612(16)10252721(33)1715(31(302617)2018(22)28352920)112414843713(14)19(23)32h21024H11H21H3(H22228)(H22332)(H2733)b2510+
MFCD05688071
ZINC000009108614
ZINC97494930
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