Vitas-M small molecule compound
methyl 4-ethyl-3'-(2-methylphenyl)-2-phenyl-2H,3'H-spiro[phthalazine-1,2'-[1,3,4]thiadiazole]-5'-carboxylate
Catalog ID
STK998523
SMILES COC(=O)C1=NN(C2(S1)N(N=C(c1c2cccc1)CC)c1ccccc1)c1ccccc1C
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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/c1-4-22-20-15-9-10-16-21(20)26(29(27-22)19-13-6-5-7-14-19)30(23-17-11-8-12-18(23)2)28-24(33-26)25(31)32-3/h5-17H,4H2,1-3H3InChIKey
YWLVBPGCVSHTKE-UHFFFAOYSA-NSynonyms
668439-31-4668439314
CCC1=NN(C2(C3=CC=CC=C31)N(N=C(S2)C(=O)OC)C4=CC=CC=C4C)C5=CC=CC=C5
InChI=1SC26H24N4O2Sc142220159101621(20)26(29(2722)19136571419)30(23171181218(23)2)2824(3326)25(31)323h517H4H213H3
methyl4ethyl2phenyl3(otolyl)2H3Hspiro(phthalazine12(134)thiadiazole)5carboxylate
methyl4ethyl3(2methylphenyl)2phenyl2H3Hspiro(phthalazine12(134)thiadiazole)5carboxylate
METHYL4ETHYL4(2METHYLPHENYL)2PHENYLSPIRO(134THIADIAZOLE51PHTHALAZINE)2CARBOXYLATE
MFCD03671364
ZINC000009075511
ZINC000013658833
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