Vitas-M small molecule compound
4-{(E)-[2-({[4-(4-bromophenyl)-5-phenyl-4H-1,2,4-triazol-2-ium-3-yl]sulfanyl}acetyl)hydrazinylidene]methyl}-2-methoxyphenolate
Catalog ID
STL037848
SMILES COc1cc(/C=N/NC(=O)CSc2[nH+]nc(n2c2ccc(cc2)Br)c2ccccc2)ccc1[O-]
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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 C24H20BrN5O3S MW 538.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H20BrN5O3S/c1-33-21-13-16(7-12-20(21)31)14-26-27-22(32)15-34-24-29-28-23(17-5-3-2-4-6-17)30(24)19-10-8-18(25)9-11-19/h2-14,31H,15H2,1H3,(H,27,32)/b26-14+InChIKey
XATVUHOPSPRHAQ-VULFUBBASA-NSynonyms
489443-50-74((E)(2(((4(4bromophenyl)5phenyl4H124triazol2ium3yl)sulfanyl)acetyl)hydrazinylidene)methyl)2methoxyphenolate
489443507
COc1cc(C=NNC(=O)CSc2(nH+)nc(n2c2ccc(cc2)Br)c2ccccc2)ccc1(O)
MFCD03218145
ZINC000002276383
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