Vitas-M small molecule compound

N-(4-bromo-2,3-dimethylphenyl)-2-[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]acetamide

Catalog ID
STK291644
SMILES O=C(Nc1ccc(c(c1C)C)Br)CSc1nnnn1c1ccccc1

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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 C17H16BrN5OS MW 418.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H16BrN5OS/c1-11-12(2)15(9-8-14(11)18)19-16(24)10-25-17-20-21-22-23(17)13-6-4-3-5-7-13/h3-9H,10H2,1-2H3,(H,19,24)
InChIKey
GGXJYJHWTXRXQZ-UHFFFAOYSA-N
Synonyms

CC1=C(C=CC(=C1C)Br)NC(=O)CSC2=NN=NN2C3=CC=CC=C3
InChI=1SC17H16BrN5OSc11112(2)15(9814(11)18)1916(24)10251720212223(17)136435713h39H10H212H3(H1924)
MFCD04217037
N(4bromo23dimethylphenyl)2((1phenyl1Htetrazol5yl)sulfanyl)acetamide
N(4BROMO23DIMETHYLPHENYL)2(1PHENYLTETRAZOL5YL)SULFANYLACETAMIDE
ZINC000001109003
ZINC01109003
ZINC1109003

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Available files

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