Vitas-M small molecule compound
5-[(benzylsulfanyl)methyl]-4-(4-bromophenyl)-4H-1,2,4-triazole-3-thiol
Catalog ID
STK440392
SMILES Brc1ccc(cc1)n1c(CSCc2ccccc2)nnc1S
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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 C16H14BrN3S2 MW 392.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H14BrN3S2/c17-13-6-8-14(9-7-13)20-15(18-19-16(20)21)11-22-10-12-4-2-1-3-5-12/h1-9H,10-11H2,(H,19,21)InChIKey
RIPCXFVRULBRHK-UHFFFAOYSA-NSynonyms
3(BENZYLSULFANYLMETHYL)4(4BROMOPHENYL)1H124TRIAZOLE5THIONE
4(4BROMOPHENYL)5((PHENYLMETHYLTHIO)METHYL)124TRIAZOLE3THIOL
5((benzylsulfanyl)methyl)4(4bromophenyl)4H124triazole3thiol
C1=CC=C(C=C1)CSCC2=NNC(=S)N2C3=CC=C(C=C3)Br
InChI=1SC16H14BrN3S2c17136814(9713)2015(181916(20)21)112210124213512h19H1011H2(H1921)
MFCD03946244
ZINC000017080084
ZINC17080084
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