Vitas-M small molecule compound
4-[1-(2,6-dichlorobenzyl)-3,5-dimethyl-1H-pyrazol-4-yl]-5-(1,3-dimethyl-1H-pyrazol-5-yl)-4H-1,2,4-triazole-3-thiol
Catalog ID
STL396152
SMILES Cc1cc(n(n1)C)c1nnc(n1c1c(C)nn(c1C)Cc1c(Cl)cccc1Cl)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/c1-10-8-16(26(4)24-10)18-22-23-19(29)28(18)17-11(2)25-27(12(17)3)9-13-14(20)6-5-7-15(13)21/h5-8H,9H2,1-4H3,(H,23,29)InChIKey
FLRRNTWMLUOZGN-UHFFFAOYSA-NSynonyms
1005625-63-71005625637
4(1((26dichlorophenyl)methyl)35dimethylpyrazol4yl)3(25dimethylpyrazol3yl)1H124triazole5thione
4(1(26DICHLOROBENZYL)35DIMETHYL1HPYRAZOL4YL)5(13DIMETHYL1HPYRAZOL5YL)4H124TRIAZOLE3THIOL
CC1=NN(C(=C1)C2=NNC(=S)N2C3=C(N(N=C3C)CC4=C(C=CC=C4Cl)Cl)C)C
InChI=1SC19H19Cl2N7Sc110816(26(4)2410)18222319(29)28(18)1711(2)2527(12(17)3)91314(20)65715(13)21h58H9H214H3(H2329)
MFCD04140091
ZINC000002730869
ZINC2730869
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