Vitas-M small molecule compound
4-{[(E)-(2,4-dichlorophenyl)methylidene]amino}-5-(5-phenyl-1H-pyrazol-3-yl)-4H-1,2,4-triazole-3-thiol
Catalog ID
STL049859
SMILES Clc1ccc(c(c1)Cl)/C=N/n1c(S)nnc1c1n[nH]c(c1)c1ccccc1
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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 C18H12Cl2N6S MW 415.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H12Cl2N6S/c19-13-7-6-12(14(20)8-13)10-21-26-17(24-25-18(26)27)16-9-15(22-23-16)11-4-2-1-3-5-11/h1-10H,(H,22,23)(H,25,27)/b21-10+InChIKey
DHOOXYHWCSDHKW-UFFVCSGVSA-NSynonyms
714936-39-7(E)4((24dichlorobenzylidene)amino)5(3phenyl1Hpyrazol5yl)4H124triazole3thiol
4(((E)(24dichlorophenyl)methylidene)amino)5(5phenyl1Hpyrazol3yl)4H124triazole3thiol
4((1E)2(24DICHLOROPHENYL)1AZAVINYL)5(3PHENYLPYRAZOL5YL)124TRIAZOLE3THIOL
4((E)(24DICHLOROPHENYL)METHYLIDENEAMINO)3(3PHENYL1HPYRAZOL5YL)1H124TRIAZOLE5THIONE
714936397
C1=CC=C(C=C1)C2=NNC(=C2)C3=NNC(=S)N3N=CC4=C(C=C(C=C4)Cl)Cl
Clc1ccc(c(c1)Cl)C=Nn1c(S)nnc1c1(nH)nc(c1)c1ccccc1
Clc1ccc(c(c1)Cl)C=Nn1c(S)nnc1c1n(nH)c(c1)c1ccccc1
InChI=1SC18H12Cl2N6Sc19137612(14(20)813)10212617(242518(26)27)16915(222316)114213511h110H(H2223)(H2527)b2110+
MFCD05736348
ZINC000009292786
ZINC33332486
Check stock
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Check stock on Vitas-MAvailable files
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