Vitas-M small molecule compound

3-[(2,5-dimethylbenzyl)sulfanyl]-5-(2-fluorophenyl)-4H-1,2,4-triazol-4-amine

Catalog ID
STL341563
SMILES Cc1ccc(c(c1)CSc1nnc(n1N)c1ccccc1F)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 C17H17FN4S MW 328.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H17FN4S/c1-11-7-8-12(2)13(9-11)10-23-17-21-20-16(22(17)19)14-5-3-4-6-15(14)18/h3-9H,10,19H2,1-2H3
InChIKey
PHSYDTQHCLKBCX-UHFFFAOYSA-N
Synonyms
585558-32-3
3((25dimethylbenzyl)sulfanyl)5(2fluorophenyl)4H124triazol4amine
3((25dimethylbenzyl)thio)5(2fluorophenyl)4H124triazol4amine
3((25DIMETHYLPHENYL)METHYLSULFANYL)5(2FLUOROPHENYL)124TRIAZOL4AMINE
5((25DIMETHYLPHENYL)METHYLTHIO)3(2FLUOROPHENYL)124TRIAZOLE4YLAMINE
585558323
CC1=CC(=C(C=C1)C)CSC2=NN=C(N2N)C3=CC=CC=C3F
InChI=1SC17H17FN4Sc1117812(2)13(911)102317212016(22(17)19)14534615(14)18h39H1019H212H3
MFCD04028345
ZINC000000532028
ZINC00532028
ZINC532028

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Available files

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