Vitas-M small molecule compound
5-(diethylammonio)-2-{(E)-[2-({[4-(4-methoxyphenyl)-5-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)hydrazinylidene]methyl}phenolate
Catalog ID
STK567529
SMILES COc1ccc(cc1)n1c(SCC(=O)N/N=C/c2ccc(cc2[O-])[NH+](CC)CC)nnc1c1ccccc1
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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 C28H30N6O3S MW 530.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H30N6O3S/c1-4-33(5-2)23-12-11-21(25(35)17-23)18-29-30-26(36)19-38-28-32-31-27(20-9-7-6-8-10-20)34(28)22-13-15-24(37-3)16-14-22/h6-18,35H,4-5,19H2,1-3H3,(H,30,36)/b29-18+InChIKey
DZRMSFUMYWYOCK-RDRPBHBLSA-NSynonyms
497170-03-3497170033
COc1ccc(cc1)n1c(SCC(=O)NN=Cc2ccc(cc2(O))(NH+)(CC)CC)nnc1c1ccccc1
MFCD03222552
ZINC000001899407
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