Vitas-M small molecule compound

N-(3-methylbenzyl)-5-(methylsulfanyl)-1H-1,2,4-triazol-3-amine

Catalog ID
STL115479
SMILES CSc1[nH]nc(n1)NCc1cccc(c1)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 C11H14N4S MW 234.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C11H14N4S/c1-8-4-3-5-9(6-8)7-12-10-13-11(16-2)15-14-10/h3-6H,7H2,1-2H3,(H2,12,13,14,15)
InChIKey
RDPSHCWFIACGJJ-UHFFFAOYSA-N
Synonyms

CC1=CC(=CC=C1)CNC2=NC(=NN2)SC
CSc1(nH)nc(n1)NCc1cccc(c1)C
InChI=1SC11H14N4Sc184359(68)712101311(162)151410h36H7H212H3(H212131415)
MFCD18912976
N((3methylphenyl)methyl)3methylsulfanyl1H124triazol5amine
N(3methylbenzyl)5(methylsulfanyl)1H124triazol3amine
ZINC000041154168
ZINC41154168

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Available files

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