Vitas-M small molecule compound
2-({[1-(4-amino-1,2,5-oxadiazol-3-yl)-4-{[(2E)-2-(4-methoxybenzylidene)hydrazinyl]carbonyl}-1H-1,2,3-triazol-5-yl]methyl}amino)benzamide
Catalog ID
STL004805
SMILES COc1ccc(cc1)/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/c1-34-13-8-6-12(7-9-13)10-25-27-21(33)17-16(31(30-26-17)20-18(22)28-35-29-20)11-24-15-5-3-2-4-14(15)19(23)32/h2-10,24H,11H2,1H3,(H2,22,28)(H2,23,32)(H,27,33)/b25-10+InChIKey
GTGJYKMILWPYOY-KIBLKLHPSA-NSynonyms
861138-32-1(E)2(((1(4amino125oxadiazol3yl)4(2(4methoxybenzylidene)hydrazinecarbonyl)1H123triazol5yl)methyl)amino)benzamide
1(4amino125oxadiazol3yl)5((2carbamoylanilino)methyl)N((E)(4methoxyphenyl)methylideneamino)triazole4carboxamide
2(((1(4amino125oxadiazol3yl)4(((2E)2(4methoxybenzylidene)hydrazinyl)carbonyl)1H123triazol5yl)methyl)amino)benzamide
861138321
COC1=CC=C(C=C1)C=NNC(=O)C2=C(N(N=N2)C3=NON=C3N)CNC4=CC=CC=C4C(=O)N
COc1ccc(cc1)C=NNC(=O)c1nnn(c1CNc1ccccc1C(=O)N)c1nonc1N
InChI=1SC21H20N10O4c134138612(7913)10252721(33)1716(31(302617)2018(22)28352920)112415532414(15)19(23)32h21024H11H21H3(H22228)(H22332)(H2733)b2510+
MFCD05683637
ZINC000009307872
ZINC103079231
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