Vitas-M small molecule compound

2-({[5-(4-methoxyphenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-1H-benzimidazole

Catalog ID
STK598065
SMILES COc1ccc(cc1)c1nnc(n1c1ccc(cc1)C)SCc1nc2c([nH]1)cccc2

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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 C24H21N5OS MW 427.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H21N5OS/c1-16-7-11-18(12-8-16)29-23(17-9-13-19(30-2)14-10-17)27-28-24(29)31-15-22-25-20-5-3-4-6-21(20)26-22/h3-14H,15H2,1-2H3,(H,25,26)
InChIKey
GDYOYIZLBVOLJH-UHFFFAOYSA-N
Synonyms
861650-91-1
1(5(BENZIMIDAZOL2YLMETHYLTHIO)4(4METHYLPHENYL)(124TRIAZOL3YL))4METHOXYBENZENE
2(((5(4METHOXYPHENYL)4(4METHYLPHENYL)4H124TRIAZOL3YL)SULFANYL)METHYL)1H13BENZODIAZOLE
2(((5(4methoxyphenyl)4(4methylphenyl)4H124triazol3yl)sulfanyl)methyl)1Hbenzimidazole
2(((5(4methoxyphenyl)4(ptolyl)4H124triazol3yl)thio)methyl)1Hbenzo(d)imidazole
2((5(4METHOXYPHENYL)4(4METHYLPHENYL)124TRIAZOL3YL)SULFANYLMETHYL)1HBENZIMIDAZOLE
861650911
CC1=CC=C(C=C1)N2C(=NN=C2SCC3=NC4=CC=CC=C4N3)C5=CC=C(C=C5)OC
COc1ccc(cc1)c1nnc(n1c1ccc(cc1)C)SCc1nc2c((nH)1)cccc2
InChI=1SC24H21N5OSc11671118(12816)2923(1791319(302)141017)272824(29)3115222520534621(20)2622h314H15H212H3(H2526)
MFCD05686401
ZINC000009308520
ZINC09308520
ZINC9308520

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Available files

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