Vitas-M small molecule compound
1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(1E)-1-(4-methoxyphenyl)ethylidene]-5-[(phenylsulfanyl)methyl]-1H-1,2,3-triazole-4-carbohydrazide
Catalog ID
STL001863
SMILES COc1ccc(cc1)/C(=N/NC(=O)c1nnn(c1CSc1ccccc1)c1nonc1N)/C
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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 C21H20N8O3S MW 464.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20N8O3S/c1-13(14-8-10-15(31-2)11-9-14)23-25-21(30)18-17(12-33-16-6-4-3-5-7-16)29(28-24-18)20-19(22)26-32-27-20/h3-11H,12H2,1-2H3,(H2,22,26)(H,25,30)/b23-13+InChIKey
FDWYOSQKRKVKSY-YDZHTSKRSA-NSynonyms
840515-47-1(E)1(4amino125oxadiazol3yl)N(1(4methoxyphenyl)ethylidene)5((phenylthio)methyl)1H123triazole4carbohydrazide
1(4amino125oxadiazol3yl)N((1E)1(4methoxyphenyl)ethylidene)5((phenylsulfanyl)methyl)1H123triazole4carbohydrazide
1(4AMINO125OXADIAZOL3YL)N((E)1(4METHOXYPHENYL)ETHYLIDENEAMINO)5(PHENYLSULFANYLMETHYL)TRIAZOLE4CARBOXAMIDE
840515471
CC(=NNC(=O)C1=C(N(N=N1)C2=NON=C2N)CSC3=CC=CC=C3)C4=CC=C(C=C4)OC
COc1ccc(cc1)C(=NNC(=O)c1nnn(c1CSc1ccccc1)c1nonc1N)C
InChI=1SC21H20N8O3Sc113(1481015(312)11914)232521(30)1817(1233166435716)29(282418)2019(22)26322720h311H12H212H3(H22226)(H2530)b2313+
MFCD04010302
ZINC000009332555
ZINC33536813
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