Vitas-M small molecule compound
1-{3'-(4-methoxyphenyl)-2-phenyl-4-[4-(propan-2-yl)phenyl]-2H,3'H-spiro[phthalazine-1,2'-[1,3,4]thiadiazol]-5'-yl}ethanone
Catalog ID
STK538002
SMILES COc1ccc(cc1)N1N=C(SC21N(N=C(c1c2cccc1)c1ccc(cc1)C(C)C)c1ccccc1)C(=O)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 C33H30N4O2S MW 546.69 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H30N4O2S/c1-22(2)24-14-16-25(17-15-24)31-29-12-8-9-13-30(29)33(36(34-31)26-10-6-5-7-11-26)37(35-32(40-33)23(3)38)27-18-20-28(39-4)21-19-27/h5-22H,1-4H3InChIKey
FWEXXKDODXCQAC-UHFFFAOYSA-NSynonyms
1(3(4methoxyphenyl)2phenyl4(4(propan2yl)phenyl)2H3Hspiro(phthalazine12(134)thiadiazol)5yl)ethanone
1(4(4isopropylphenyl)3(4methoxyphenyl)2phenyl2H3Hspiro(phthalazine12(134)thiadiazol)5yl)ethanone
1(4(4METHOXYPHENYL)2PHENYL4(4PROPAN2YLPHENYL)SPIRO(134THIADIAZOLE51PHTHALAZINE)2YL)ETHANONE
CC(C)C1=CC=C(C=C1)C2=NN(C3(C4=CC=CC=C42)N(N=C(S3)C(=O)C)C5=CC=C(C=C5)OC)C6=CC=CC=C6
InChI=1SC33H30N4O2Sc122(2)24141625(171524)312912891330(29)33(36(3431)26106571126)37(3532(4033)23(3)38)27182028(394)211927h522H14H3
MFCD00754959
ZINC000097950421
ZINC000097950422
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