Vitas-M small molecule compound
1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(1E)-3-methyl-4-oxonaphthalen-1(4H)-ylidene]-5-(morpholin-4-ylmethyl)-1H-1,2,3-triazole-4-carbohydrazide
Catalog ID
STK759728
SMILES CC1=C/C(=N\NC(=O)c2nnn(c2CN2CCOCC2)c2nonc2N)/c2c(C1=O)cccc2
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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 C21H21N9O4 MW 463.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21N9O4/c1-12-10-15(13-4-2-3-5-14(13)18(12)31)23-25-21(32)17-16(11-29-6-8-33-9-7-29)30(28-24-17)20-19(22)26-34-27-20/h2-5,10H,6-9,11H2,1H3,(H2,22,26)(H,25,32)/b23-15+InChIKey
WKRGVXZFYLLZAA-HZHRSRAPSA-NSynonyms
1(4amino125oxadiazol3yl)N((1E)3methyl4oxonaphthalen1(4H)ylidene)5(morpholin4ylmethyl)1H123triazole4carbohydrazide
1(4AMINO125OXADIAZOL3YL)N((E)(3METHYL4OXONAPHTHALEN1YLIDENE)AMINO)5(MORPHOLIN4YLMETHYL)TRIAZOLE4CARBOXAMIDE
CC1=CC(=NNC(=O)C2=C(N(N=N2)C3=NON=C3N)CN4CCOCC4)C5=CC=CC=C5C1=O
CC1=CC(=NNC(=O)c2nnn(c2CN2CCOCC2)c2nonc2N)c2c(C1=O)cccc2
InChI=1SC21H21N9O4c1121015(13423514(13)18(12)31)232521(32)1716(112968339729)30(282417)2019(22)26342720h2510H6911H21H3(H22226)(H2532)b2315+
MFCD01572620
ZINC000019830758
ZINC100111650
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