Vitas-M small molecule compound

2-(4-chlorophenyl)-5-(4'-pentylbiphenyl-4-yl)-1,3,4-thiadiazole

Catalog ID
STK057395
SMILES CCCCCc1ccc(cc1)c1ccc(cc1)c1nnc(s1)c1ccc(cc1)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 C25H23ClN2S MW 418.99 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H23ClN2S/c1-2-3-4-5-18-6-8-19(9-7-18)20-10-12-21(13-11-20)24-27-28-25(29-24)22-14-16-23(26)17-15-22/h6-17H,2-5H2,1H3
InChIKey
CKJHWZFHWJGMDT-UHFFFAOYSA-N
Synonyms

2(4CHLOROPHENYL)5(4(4PENTYLPHENYL)PHENYL)134THIADIAZOLE
2(4CHLOROPHENYL)5(4PENTYLBIPHENYL4YL)134THIADIAZOLE
CCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)C3=NN=C(S3)C4=CC=C(C=C4)Cl
InChI=1SC25H23ClN2Sc12345186819(9718)20101221(131120)24272825(2924)22141623(26)171522h617H25H21H3
MFCD00990170
STK057395
ZINC000005119605
ZINC05119605
ZINC5119605

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.