Vitas-M small molecule compound

2-({[1-(2,4-dimethylphenyl)-1H-tetrazol-5-yl]methyl}sulfanyl)-1-methyl-1H-benzimidazole

Catalog ID
STK855152
SMILES Cc1ccc(c(c1)C)n1nnnc1CSc1nc2c(n1C)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 C18H18N6S MW 350.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18N6S/c1-12-8-9-15(13(2)10-12)24-17(20-21-22-24)11-25-18-19-14-6-4-5-7-16(14)23(18)3/h4-10H,11H2,1-3H3
InChIKey
VYDXPEUXILDEBU-UHFFFAOYSA-N
Synonyms
898653-23-1
2(((1(24dimethylphenyl)1Htetrazol5yl)methyl)sulfanyl)1methyl1Hbenzimidazole
2(((1(24dimethylphenyl)1Htetrazol5yl)methyl)thio)1methyl1Hbenzo(d)imidazole
2((1(24dimethylphenyl)tetrazol5yl)methylsulfanyl)1methylbenzimidazole
898653231
CC1=CC(=C(C=C1)N2C(=NN=N2)CSC3=NC4=CC=CC=C4N3C)C
InChI=1SC18H18N6Sc1128915(13(2)1012)2417(20212224)1125181914645716(14)23(18)3h410H11H213H3
MFCD08291963
ZINC000006665373
ZINC06665373
ZINC6665373

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Available files

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