Vitas-M small molecule compound

ethyl 4-methyl-3'-(4-methylphenyl)-2-phenyl-2H,3'H-spiro[phthalazine-1,2'-[1,3,4]thiadiazole]-5'-carboxylate

Catalog ID
STK838073
SMILES CCOC(=O)C1=NN(C2(S1)c1ccccc1C(=NN2c1ccccc1)C)c1ccc(cc1)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 C26H24N4O2S MW 456.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H24N4O2S/c1-4-32-25(31)24-28-30(21-16-14-18(2)15-17-21)26(33-24)23-13-9-8-12-22(23)19(3)27-29(26)20-10-6-5-7-11-20/h5-17H,4H2,1-3H3
InChIKey
FVEGLLITODYNJS-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1=NN(C2(S1)C3=CC=CC=C3C(=NN2C4=CC=CC=C4)C)C5=CC=C(C=C5)C
ethyl4methyl2phenyl3(ptolyl)2H3Hspiro(phthalazine12(134)thiadiazole)5carboxylate
ethyl4methyl3(4methylphenyl)2phenyl2H3Hspiro(phthalazine12(134)thiadiazole)5carboxylate
ETHYL4METHYL4(4METHYLPHENYL)2PHENYLSPIRO(134THIADIAZOLE51PHTHALAZINE)2CARBOXYLATE
InChI=1SC26H24N4O2Sc143225(31)242830(21161418(2)151721)26(3324)2313981222(23)19(3)2729(26)20106571120h517H4H213H3
MFCD00828334
ZINC000008969723
ZINC000008969725

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Available files

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