Vitas-M small molecule compound
1-[3,3-bis(4-methylphenyl)-3'-phenyl-3H,3'H-spiro[2-benzothiophene-1,2'-[1,3,4]thiadiazol]-5'-yl]ethanone
Catalog ID
STK762575
SMILES Cc1ccc(cc1)C1(SC2(c3c1cccc3)SC(=NN2c1ccccc1)C(=O)C)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 C31H26N2OS2 MW 506.69 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H26N2OS2/c1-21-13-17-24(18-14-21)30(25-19-15-22(2)16-20-25)27-11-7-8-12-28(27)31(36-30)33(26-9-5-4-6-10-26)32-29(35-31)23(3)34/h4-20H,1-3H3InChIKey
GXAVNMRYAKOEJE-UHFFFAOYSA-NSynonyms
1(33BIS(4METHYLPHENYL)3PHENYL3H3HSPIRO(2BENZOTHIOPHENE12(134)THIADIAZOL)5YL)ETHANONE
1(33BIS(4METHYLPHENYL)4PHENYLSPIRO(134THIADIAZOLE512BENZOTHIOPHENE)2YL)ETHANONE
5ACETYL33BIS(4METHYLPHENYL)3PHENYLSPIRO(BENZO(C)THIOPHENE1(3H)2(3H)(134)THIADIAZOLE)
CC1=CC=C(C=C1)C2(C3=CC=CC=C3C4(S2)N(N=C(S4)C(=O)C)C5=CC=CC=C5)C6=CC=C(C=C6)C
InChI=1SC31H26N2OS2c121131724(181421)30(25191522(2)162025)2711781228(27)31(3630)33(2695461026)3229(3531)23(3)34h420H13H3
MFCD00310640
ZINC000009514226
ZINC000015218512
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