Vitas-M small molecule compound
1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(2,3-dichlorophenyl)methylidene]-5-{[(4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}-1H-1,2,3-triazole-4-carbohydrazide
Catalog ID
STL347896
SMILES O=C(c1nnn(c1CSc1nncn1C)c1nonc1N)N/N=C/c1cccc(c1Cl)Cl
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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 C16H13Cl2N11O2S MW 494.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H13Cl2N11O2S/c1-28-7-21-24-16(28)32-6-10-12(22-27-29(10)14-13(19)25-31-26-14)15(30)23-20-5-8-3-2-4-9(17)11(8)18/h2-5,7H,6H2,1H3,(H2,19,25)(H,23,30)/b20-5+InChIKey
QYQTZPISXOHTFH-DENHBWNVSA-NSynonyms
861629-13-2(E)1(4amino125oxadiazol3yl)N(23dichlorobenzylidene)5(((4methyl4H124triazol3yl)thio)methyl)1H123triazole4carbohydrazide
1(4amino125oxadiazol3yl)N((E)(23dichlorophenyl)methylidene)5(((4methyl4H124triazol3yl)sulfanyl)methyl)1H123triazole4carbohydrazide
1(4amino125oxadiazol3yl)N((E)(23dichlorophenyl)methylideneamino)5((4methyl124triazol3yl)sulfanylmethyl)triazole4carboxamide
861629132
CN1C=NN=C1SCC2=C(N=NN2C3=NON=C3N)C(=O)NN=CC4=C(C(=CC=C4)Cl)Cl
InChI=1SC16H13Cl2N11O2Sc1287212416(28)3261012(222729(10)1413(19)25312614)15(30)2320583249(17)11(8)18h257H6H21H3(H21925)(H2330)b205+
MFCD05684789
O=C(c1nnn(c1CSc1nncn1C)c1nonc1N)NN=Cc1cccc(c1Cl)Cl
ZINC000009478251
ZINC35242299
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