Vitas-M small molecule compound

1-[1-(4-chlorobenzyl)-3,5-dimethyl-1H-pyrazol-4-yl]-1H-tetrazole

Catalog ID
STK305561
SMILES Clc1ccc(cc1)Cn1nc(c(c1C)n1cnnn1)C

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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 C13H13ClN6 MW 288.74 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H13ClN6/c1-9-13(20-8-15-17-18-20)10(2)19(16-9)7-11-3-5-12(14)6-4-11/h3-6,8H,7H2,1-2H3
InChIKey
NMZMGQRUONLNDR-UHFFFAOYSA-N
Synonyms
1005558-15-5
1(1((4CHLOROPHENYL)METHYL)35DIMETHYLPYRAZOL4YL)TETRAZOLE
1(1(4chlorobenzyl)35dimethyl1Hpyrazol4yl)1Htetrazole
1005558155
CC1=C(C(=NN1CC2=CC=C(C=C2)Cl)C)N3C=NN=N3
InChI=1SC13H13ClN6c1913(20815171820)10(2)19(169)7113512(14)6411h368H7H212H3
MFCD04050952
ZINC000002786716
ZINC02786716
ZINC2786716

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Available files

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