Vitas-M small molecule compound
4-[1-(3,4-dichlorobenzyl)-3,5-dimethyl-1H-pyrazol-4-yl]-5-(1-ethyl-1H-pyrazol-4-yl)-4H-1,2,4-triazole-3-thiol
Catalog ID
STL391567
SMILES CCn1ncc(c1)c1nnc(n1c1c(C)nn(c1C)Cc1ccc(c(c1)Cl)Cl)S
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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 C19H19Cl2N7S MW 448.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H19Cl2N7S/c1-4-26-10-14(8-22-26)18-23-24-19(29)28(18)17-11(2)25-27(12(17)3)9-13-5-6-15(20)16(21)7-13/h5-8,10H,4,9H2,1-3H3,(H,24,29)InChIKey
QJSAEFXNRBURID-UHFFFAOYSA-NSynonyms
1005627-67-71005627677
4(1((34dichlorophenyl)methyl)35dimethylpyrazol4yl)3(1ethylpyrazol4yl)1H124triazole5thione
4(1(34dichlorobenzyl)35dimethyl1Hpyrazol4yl)5(1ethyl1Hpyrazol4yl)4H124triazole3thiol
CCN1C=C(C=N1)C2=NNC(=S)N2C3=C(N(N=C3C)CC4=CC(=C(C=C4)Cl)Cl)C
InChI=1SC19H19Cl2N7Sc14261014(82226)18232419(29)28(18)1711(2)2527(12(17)3)9135615(20)16(21)713h5810H49H213H3(H2429)
MFCD04140360
ZINC000002731162
ZINC2731162
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