Vitas-M small molecule compound
ethyl 4-(4-chlorophenyl)-3'-(4-methylphenyl)-2-phenyl-2H,3'H-spiro[phthalazine-1,2'-[1,3,4]thiadiazole]-5'-carboxylate
Catalog ID
STK672673
SMILES CCOC(=O)C1=NN(C2(S1)N(N=C(c1c2cccc1)c1ccc(cc1)Cl)c1ccccc1)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 C31H25ClN4O2S MW 553.08 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H25ClN4O2S/c1-3-38-30(37)29-34-36(25-19-13-21(2)14-20-25)31(39-29)27-12-8-7-11-26(27)28(22-15-17-23(32)18-16-22)33-35(31)24-9-5-4-6-10-24/h4-20H,3H2,1-2H3InChIKey
ABDXHCNKBKZJSR-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=NN(C2(S1)C3=CC=CC=C3C(=NN2C4=CC=CC=C4)C5=CC=C(C=C5)Cl)C6=CC=C(C=C6)C
ethyl4(4chlorophenyl)2phenyl3(ptolyl)2H3Hspiro(phthalazine12(134)thiadiazole)5carboxylate
ethyl4(4chlorophenyl)3(4methylphenyl)2phenyl2H3Hspiro(phthalazine12(134)thiadiazole)5carboxylate
ETHYL4(4CHLOROPHENYL)4(4METHYLPHENYL)2PHENYLSPIRO(134THIADIAZOLE51PHTHALAZINE)2CARBOXYLATE
InChI=1SC31H25ClN4O2Sc133830(37)293436(25191321(2)142025)31(3929)2712871126(27)28(22151723(32)181622)3335(31)2495461024h420H3H212H3
MFCD00762115
ZINC000033353641
ZINC000033353643
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