Vitas-M small molecule compound
1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(dimethylamino)methyl]-N'-[(E)-(2-methoxynaphthalen-1-yl)methylidene]-1H-1,2,3-triazole-4-carbohydrazide
Catalog ID
STL004385
SMILES COc1ccc2c(c1/C=N/NC(=O)c1nnn(c1CN(C)C)c1nonc1N)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 C20H21N9O3 MW 435.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21N9O3/c1-28(2)11-15-17(23-27-29(15)19-18(21)25-32-26-19)20(30)24-22-10-14-13-7-5-4-6-12(13)8-9-16(14)31-3/h4-10H,11H2,1-3H3,(H2,21,25)(H,24,30)/b22-10+InChIKey
IHXISQHIBNGING-LSHDLFTRSA-NSynonyms
577989-76-5(E)1(4amino125oxadiazol3yl)5((dimethylamino)methyl)N((2methoxynaphthalen1yl)methylene)1H123triazole4carbohydrazide
1(4amino125oxadiazol3yl)5((dimethylamino)methyl)N((E)(2methoxynaphthalen1yl)methylidene)1H123triazole4carbohydrazide
1(4amino125oxadiazol3yl)5((dimethylamino)methyl)N((E)(2methoxynaphthalen1yl)methylideneamino)triazole4carboxamide
577989765
CN(C)CC1=C(N=NN1C2=NON=C2N)C(=O)NN=CC3=C(C=CC4=CC=CC=C43)OC
COc1ccc2c(c1C=NNC(=O)c1nnn(c1CN(C)C)c1nonc1N)cccc2
InChI=1SC20H21N9O3c128(2)111517(232729(15)1918(21)25322619)20(30)2422101413754612(13)8916(14)313h410H11H213H3(H22125)(H2430)b2210+
MFCD03339408
ZINC000002349468
ZINC15979055
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