Vitas-M small molecule compound

6-amino-2-({[1-(3,4-dichlorophenyl)-1H-tetrazol-5-yl]methyl}sulfanyl)pyrimidin-4-ol

Catalog ID
STK630158
SMILES Nc1nc(SCc2nnnn2c2ccc(c(c2)Cl)Cl)nc(c1)O

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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 C12H9Cl2N7OS MW 370.22 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H9Cl2N7OS/c13-7-2-1-6(3-8(7)14)21-10(18-19-20-21)5-23-12-16-9(15)4-11(22)17-12/h1-4H,5H2,(H3,15,16,17,22)
InChIKey
LGEGFQZBDZSTHV-UHFFFAOYSA-N
Synonyms
912899-52-6
6amino2(((1(34dichlorophenyl)1Htetrazol5yl)methyl)sulfanyl)pyrimidin4ol
6amino2((1(34dichlorophenyl)tetrazol5yl)methylsulfanyl)1Hpyrimidin4one
912899526
C1=CC(=C(C=C1N2C(=NN=N2)CSC3=NC(=O)C=C(N3)N)Cl)Cl
InChI=1SC12H9Cl2N7OSc137216(38(7)14)2110(18192021)52312169(15)411(22)1712h14H5H2(H315161722)
MFCD09761227
ZINC000016669647
ZINC16669647

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Available files

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