Vitas-M small molecule compound
2-{[5-(1,5-dimethyl-1H-pyrazol-3-yl)-4-(tetrahydrofuran-2-ylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(1Z)-1-(4-hydroxy-6-methyl-2-oxo-2H-pyran-3-yl)ethylidene]acetohydrazide
Catalog ID
STK303339
SMILES O=C(CSc1nnc(n1CC1CCCO1)c1cc(n(n1)C)C)N/N=C(\c1c(O)cc(oc1=O)C)/C
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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 C22H27N7O5S MW 501.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H27N7O5S/c1-12-8-16(27-28(12)4)20-25-26-22(29(20)10-15-6-5-7-33-15)35-11-18(31)24-23-14(3)19-17(30)9-13(2)34-21(19)32/h8-9,15,30H,5-7,10-11H2,1-4H3,(H,24,31)/b23-14-InChIKey
CYZHNGUMXPMBBJ-UCQKPKSFSA-NSynonyms
1005604-75-01005604750
2((5(15dimethyl1Hpyrazol3yl)4(tetrahydrofuran2ylmethyl)4H124triazol3yl)sulfanyl)N((1Z)1(4hydroxy6methyl2oxo2Hpyran3yl)ethylidene)acetohydrazide
MFCD06195321
O=C(CSc1nnc(n1CC1CCCO1)c1cc(n(n1)C)C)NN=C(c1c(O)cc(oc1=O)C)C
ZINC000008815630
ZINC000012446593
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