Vitas-M small molecule compound
ethyl 4-(2,5-dimethylphenyl)-2,3'-diphenyl-2H,3'H-spiro[phthalazine-1,2'-[1,3,4]thiadiazole]-5'-carboxylate
Catalog ID
STK733668
SMILES CCOC(=O)C1=NN(C2(S1)N(N=C(c1c2cccc1)c1cc(C)ccc1C)c1ccccc1)c1ccccc1
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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 C32H28N4O2S MW 532.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H28N4O2S/c1-4-38-31(37)30-34-36(25-15-9-6-10-16-25)32(39-30)28-18-12-11-17-26(28)29(27-21-22(2)19-20-23(27)3)33-35(32)24-13-7-5-8-14-24/h5-21H,4H2,1-3H3InChIKey
CQWQVOMKXFJAIH-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=NN(C2(S1)C3=CC=CC=C3C(=NN2C4=CC=CC=C4)C5=C(C=CC(=C5)C)C)C6=CC=CC=C6
ethyl4(25dimethylphenyl)23diphenyl2H3Hspiro(phthalazine12(134)thiadiazole)5carboxylate
ETHYL4(25DIMETHYLPHENYL)24DIPHENYLSPIRO(134THIADIAZOLE51PHTHALAZINE)2CARBOXYLATE
InChI=1SC32H28N4O2Sc143831(37)303436(251596101625)32(3930)281812111726(28)29(272122(2)192023(27)3)3335(32)24137581424h521H4H213H3
MFCD01465224
ZINC000008424482
ZINC000008424483
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