Vitas-M small molecule compound
4-{[(1E,2Z)-2-chloro-3-phenylprop-2-en-1-ylidene]amino}-5-(3,4-dimethoxyphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Catalog ID
STL149469
SMILES COc1cc(ccc1OC)c1n[nH]c(=S)n1/N=C/C(=C/c1ccccc1)/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 C19H17ClN4O2S MW 400.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H17ClN4O2S/c1-25-16-9-8-14(11-17(16)26-2)18-22-23-19(27)24(18)21-12-15(20)10-13-6-4-3-5-7-13/h3-12H,1-2H3,(H,23,27)/b15-10-,21-12+InChIKey
MFZVNKLIKIFAKN-ZNGUSHDYSA-NSynonyms
488094-67-3488094673
COc1cc(ccc1OC)c1n(nH)c(=S)n1N=CC(=Cc1ccccc1)Cl
MFCD03793586
ZINC000002326222
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