Vitas-M small molecule compound
ethyl 3'-(3-chlorophenyl)-3,3-bis(4-methylphenyl)-3H,3'H-spiro[2-benzothiophene-1,2'-[1,3,4]thiadiazole]-5'-carboxylate
Catalog ID
STK674748
SMILES CCOC(=O)C1=NN(C2(S1)SC(c1c2cccc1)(c1ccc(cc1)C)c1ccc(cc1)C)c1cccc(c1)Cl
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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 C32H27ClN2O2S2 MW 571.16 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H27ClN2O2S2/c1-4-37-30(36)29-34-35(26-9-7-8-25(33)20-26)32(38-29)28-11-6-5-10-27(28)31(39-32,23-16-12-21(2)13-17-23)24-18-14-22(3)15-19-24/h5-20H,4H2,1-3H3InChIKey
HZDXRJIKEGFONB-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=NN(C2(S1)C3=CC=CC=C3C(S2)(C4=CC=C(C=C4)C)C5=CC=C(C=C5)C)C6=CC(=CC=C6)Cl
ethyl3(3chlorophenyl)33bis(4methylphenyl)3H3Hspiro(2benzothiophene12(134)thiadiazole)5carboxylate
ethyl3(3chlorophenyl)33diptolyl3H3Hspiro(benzo(c)thiophene12(134)thiadiazole)5carboxylate
ETHYL4(3CHLOROPHENYL)33BIS(4METHYLPHENYL)SPIRO(134THIADIAZOLE512BENZOTHIOPHENE)2CARBOXYLATE
InChI=1SC32H27ClN2O2S2c143730(36)293435(2697825(33)2026)32(3829)2811651027(28)31(393223161221(2)131723)24181422(3)151924h520H4H213H3
MFCD01204190
ZINC000033355497
ZINC000033355498
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