Vitas-M small molecule compound
5-(4-chloro-1-ethyl-1H-pyrazol-5-yl)-4-[1-(4-methylbenzyl)-1H-pyrazol-4-yl]-4H-1,2,4-triazole-3-thiol
Catalog ID
STL393062
SMILES CCn1ncc(c1c1nnc(n1c1cnn(c1)Cc1ccc(cc1)C)S)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 C18H18ClN7S MW 399.91 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18ClN7S/c1-3-25-16(15(19)9-21-25)17-22-23-18(27)26(17)14-8-20-24(11-14)10-13-6-4-12(2)5-7-13/h4-9,11H,3,10H2,1-2H3,(H,23,27)InChIKey
NFENDSSKUIHIGH-UHFFFAOYSA-NSynonyms
1005623-42-61005623426
3(4chloro2ethylpyrazol3yl)4(1((4methylphenyl)methyl)pyrazol4yl)1H124triazole5thione
5(4CHLORO1ETHYL1HPYRAZOL5YL)4(1(4METHYLBENZYL)1HPYRAZOL4YL)4H124TRIAZOLE3THIOL
CCN1C(=C(C=N1)Cl)C2=NNC(=S)N2C3=CN(N=C3)CC4=CC=C(C=C4)C
InChI=1SC18H18ClN7Sc132516(15(19)92125)17222318(27)26(17)1482024(1114)10136412(2)5713h4911H310H212H3(H2327)
MFCD04137685
ZINC000002809176
ZINC02809176
ZINC2809176
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