Vitas-M small molecule compound

1-[3'-(3-chlorophenyl)-3,3-bis(2-methylphenyl)-3H,3'H-spiro[2-benzothiophene-1,2'-[1,3,4]thiadiazol]-5'-yl]ethanone

Catalog ID
STK675614
SMILES Clc1cccc(c1)N1N=C(SC21SC(c1c2cccc1)(c1ccccc1C)c1ccccc1C)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 C31H25ClN2OS2 MW 541.14 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H25ClN2OS2/c1-20-11-4-6-15-25(20)30(26-16-7-5-12-21(26)2)27-17-8-9-18-28(27)31(37-30)34(33-29(36-31)22(3)35)24-14-10-13-23(32)19-24/h4-19H,1-3H3
InChIKey
SQLHLDSDTGSUFM-UHFFFAOYSA-N
Synonyms

1(3(3chlorophenyl)33bis(2methylphenyl)3H3Hspiro(2benzothiophene12(134)thiadiazol)5yl)ethanone
1(4(3CHLOROPHENYL)33BIS(2METHYLPHENYL)SPIRO(134THIADIAZOLE512BENZOTHIOPHENE)2YL)ETHANONE
CC1=CC=CC=C1C2(C3=CC=CC=C3C4(S2)N(N=C(S4)C(=O)C)C5=CC(=CC=C5)Cl)C6=CC=CC=C6C
InChI=1SC31H25ClN2OS2c12011461525(20)30(2616751221(26)2)2717891828(27)31(3730)34(3329(3631)22(3)35)2414101323(32)1924h419H13H3
MFCD01575677
ZINC000008443973
ZINC000008443974

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Available files

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