Vitas-M small molecule compound

3-[(4-methylbenzyl)sulfanyl]-5-phenyl-4H-1,2,4-triazol-4-amine

Catalog ID
STL358106
SMILES Cc1ccc(cc1)CSc1nnc(n1N)c1ccccc1

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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 C16H16N4S MW 296.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H16N4S/c1-12-7-9-13(10-8-12)11-21-16-19-18-15(20(16)17)14-5-3-2-4-6-14/h2-10H,11,17H2,1H3
InChIKey
XIENVKCELBMITQ-UHFFFAOYSA-N
Synonyms
573669-53-1
3((4methylbenzyl)sulfanyl)5phenyl4H124triazol4amine
3((4methylbenzyl)thio)5phenyl4H124triazol4amine
3((4METHYLPHENYL)METHYLSULFANYL)5PHENYL124TRIAZOL4AMINE
3((4METHYLPHENYL)METHYLTHIO)5PHENYL124TRIAZOLE4YLAMINE
573669531
CC1=CC=C(C=C1)CSC2=NN=C(N2N)C3=CC=CC=C3
InChI=1SC16H16N4Sc1127913(10812)112116191815(20(16)17)145324614h210H1117H21H3
MFCD03609816
ZINC000000149760
ZINC00149760
ZINC149760

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Available files

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