Vitas-M small molecule compound
ethyl 3'-(4-bromophenyl)-4-(4-ethylphenyl)-2-phenyl-2H,3'H-spiro[phthalazine-1,2'-[1,3,4]thiadiazole]-5'-carboxylate
Catalog ID
STK537561
SMILES CCOC(=O)C1=NN(C2(S1)N(N=C(c1c2cccc1)c1ccc(cc1)CC)c1ccccc1)c1ccc(cc1)Br
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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 C32H27BrN4O2S MW 611.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H27BrN4O2S/c1-3-22-14-16-23(17-15-22)29-27-12-8-9-13-28(27)32(36(34-29)25-10-6-5-7-11-25)37(26-20-18-24(33)19-21-26)35-30(40-32)31(38)39-4-2/h5-21H,3-4H2,1-2H3InChIKey
LFJFVEHEVZHVQQ-UHFFFAOYSA-NSynonyms
CCC1=CC=C(C=C1)C2=NN(C3(C4=CC=CC=C42)N(N=C(S3)C(=O)OCC)C5=CC=C(C=C5)Br)C6=CC=CC=C6
ethyl3(4bromophenyl)4(4ethylphenyl)2phenyl2H3Hspiro(phthalazine12(134)thiadiazole)5carboxylate
ETHYL4(4BROMOPHENYL)4(4ETHYLPHENYL)2PHENYLSPIRO(134THIADIAZOLE51PHTHALAZINE)2CARBOXYLATE
InChI=1SC32H27BrN4O2Sc1322141623(171522)292712891328(27)32(36(3429)25106571125)37(26201824(33)192126)3530(4032)31(38)3942h521H34H212H3
MFCD00754970
ZINC000102421027
ZINC000102421030
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