Vitas-M small molecule compound
2-{(E)-[2-({[4,5-bis(4-chlorophenyl)-4H-1,2,4-triazol-2-ium-3-yl]sulfanyl}acetyl)hydrazinylidene]methyl}-6-methoxyphenolate
Catalog ID
STL045200
SMILES COc1cccc(c1[O-])/C=N/NC(=O)CSc1[nH+]nc(n1c1ccc(cc1)Cl)c1ccc(cc1)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 C24H19Cl2N5O3S MW 528.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H19Cl2N5O3S/c1-34-20-4-2-3-16(22(20)33)13-27-28-21(32)14-35-24-30-29-23(15-5-7-17(25)8-6-15)31(24)19-11-9-18(26)10-12-19/h2-13,33H,14H2,1H3,(H,28,32)/b27-13+InChIKey
SQXZSCYBFYDAAC-UVHMKAGCSA-NSynonyms
488811-60-52((E)(2(((45bis(4chlorophenyl)4H124triazol2ium3yl)sulfanyl)acetyl)hydrazinylidene)methyl)6methoxyphenolate
488811605
COc1cccc(c1(O))C=NNC(=O)CSc1(nH+)nc(n1c1ccc(cc1)Cl)c1ccc(cc1)Cl
MFCD03293498
ZINC000002353626
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