Vitas-M small molecule compound

3-[(4-bromobenzyl)sulfanyl]-5-(3-methylphenyl)-4H-1,2,4-triazol-4-amine

Catalog ID
STL341515
SMILES Brc1ccc(cc1)CSc1nnc(n1N)c1cccc(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 C16H15BrN4S MW 375.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H15BrN4S/c1-11-3-2-4-13(9-11)15-19-20-16(21(15)18)22-10-12-5-7-14(17)8-6-12/h2-9H,10,18H2,1H3
InChIKey
PLOAASIHFPDTSW-UHFFFAOYSA-N
Synonyms
585549-72-0
3((4bromobenzyl)sulfanyl)5(3methylphenyl)4H124triazol4amine
3((4bromobenzyl)thio)5(mtolyl)4H124triazol4amine
3((4BROMOPHENYL)METHYLSULFANYL)5(3METHYLPHENYL)124TRIAZOL4AMINE
3((4BROMOPHENYL)METHYLTHIO)5(3METHYLPHENYL)124TRIAZOLE4YLAMINE
585549720
CC1=CC=CC(=C1)C2=NN=C(N2N)SCC3=CC=C(C=C3)Br
InChI=1SC16H15BrN4Sc11132413(911)15192016(21(15)18)2210125714(17)8612h29H1018H21H3
MFCD04027969
ZINC000002382727
ZINC02382727
ZINC2382727

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Available files

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