Vitas-M small molecule compound
4-[1-(3,4-dichlorobenzyl)-3,5-dimethyl-1H-pyrazol-4-yl]-5-[(3-methyl-1H-pyrazol-1-yl)methyl]-4H-1,2,4-triazole-3-thiol
Catalog ID
STK311812
SMILES Cc1ccn(n1)Cc1nnc(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/c1-11-6-7-26(24-11)10-17-22-23-19(29)28(17)18-12(2)25-27(13(18)3)9-14-4-5-15(20)16(21)8-14/h4-8H,9-10H2,1-3H3,(H,23,29)InChIKey
CTOPDIKTBFWJOL-UHFFFAOYSA-NSynonyms
1005672-99-01005672990
4(1((34dichlorophenyl)methyl)35dimethylpyrazol4yl)3((3methylpyrazol1yl)methyl)1H124triazole5thione
4(1(34dichlorobenzyl)35dimethyl1Hpyrazol4yl)5((3methyl1Hpyrazol1yl)methyl)4H124triazole3thiol
CC1=NN(C=C1)CC2=NNC(=S)N2C3=C(N(N=C3C)CC4=CC(=C(C=C4)Cl)Cl)C
InChI=1SC19H19Cl2N7Sc1116726(2411)1017222319(29)28(17)1812(2)2527(13(18)3)9144515(20)16(21)814h48H910H213H3(H2329)
MFCD04140094
ZINC000002730872
ZINC02730872
ZINC2730872
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