Vitas-M small molecule compound
N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-2-[(6-{[(E)-(4-iodophenyl)methylidene]amino}-1,3-benzothiazol-2-yl)sulfanyl]acetamide
Catalog ID
STK673666
SMILES O=C(Nc1c(C)n(n(c1=O)c1ccccc1)C)CSc1nc2c(s1)cc(cc2)/N=C/c1ccc(cc1)I
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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 C27H22IN5O2S2 MW 639.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H22IN5O2S2/c1-17-25(26(35)33(32(17)2)21-6-4-3-5-7-21)31-24(34)16-36-27-30-22-13-12-20(14-23(22)37-27)29-15-18-8-10-19(28)11-9-18/h3-15H,16H2,1-2H3,(H,31,34)/b29-15+InChIKey
XHYQJBMPHGBAJA-WKULSOCRSA-NSynonyms
MFCD01232646
N(15dimethyl3oxo2phenyl23dihydro1Hpyrazol4yl)2((6(((E)(4iodophenyl)methylidene)amino)13benzothiazol2yl)sulfanyl)acetamide
O=C(Nc1c(C)n(n(c1=O)c1ccccc1)C)CSc1nc2c(s1)cc(cc2)N=Cc1ccc(cc1)I
ZINC000150357177
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