Vitas-M small molecule compound

6-(1H-benzimidazol-2-ylsulfanyl)-N,N'-bis(3,4-dimethylphenyl)-1,3,5-triazine-2,4-diamine

Catalog ID
STK045274
SMILES Cc1ccc(cc1C)Nc1nc(Nc2ccc(c(c2)C)C)nc(n1)Sc1nc2c([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 C26H25N7S MW 467.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H25N7S/c1-15-9-11-19(13-17(15)3)27-23-31-24(28-20-12-10-16(2)18(4)14-20)33-26(32-23)34-25-29-21-7-5-6-8-22(21)30-25/h5-14H,1-4H3,(H,29,30)(H2,27,28,31,32,33)
InChIKey
UFUVEILVQTZCHC-UHFFFAOYSA-N
Synonyms
351423-62-6
351423626
6((1Hbenzo(d)imidazol2yl)thio)N2N4bis(34dimethylphenyl)135triazine24diamine
6(1HBENZIMIDAZOL2YLSULFANYL)2N4NBIS(34DIMETHYLPHENYL)135TRIAZINE24DIAMINE
6(1HBENZIMIDAZOL2YLSULFANYL)NNBIS(34DIMETHYLPHENYL)135TRIAZINE24DIAMINE
CC1=C(C=C(C=C1)NC2=NC(=NC(=N2)SC3=NC4=CC=CC=C4N3)NC5=CC(=C(C=C5)C)C)C
Cc1ccc(cc1C)Nc1nc(Nc2ccc(c(c2)C)C)nc(n1)Sc1nc2c((nH)1)cccc2
InChI=1SC26H25N7Sc11591119(1317(15)3)27233124(2820121016(2)18(4)1420)3326(3223)34252921756822(21)3025h514H14H3(H2930)(H22728313233)
MFCD01948598
STK045274
ZINC000009246545
ZINC09246545
ZINC9246545

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Available files

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