Vitas-M small molecule compound
4-(4-bromophenyl)-5-(2-phenylethyl)-4H-1,2,4-triazole-3-thiol
Catalog ID
STK444156
SMILES Brc1ccc(cc1)n1c(nnc1S)CCc1ccccc1
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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 C16H14BrN3S MW 360.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H14BrN3S/c17-13-7-9-14(10-8-13)20-15(18-19-16(20)21)11-6-12-4-2-1-3-5-12/h1-5,7-10H,6,11H2,(H,19,21)InChIKey
FZQXUCKGFCJYNN-UHFFFAOYSA-NSynonyms
4(4bromophenyl)3(2phenylethyl)1H124triazole5thione
4(4BROMOPHENYL)5(2PHENYLETHYL)124TRIAZOLE3THIOL
4(4bromophenyl)5(2phenylethyl)4H124triazole3thiol
C1=CC=C(C=C1)CCC2=NNC(=S)N2C3=CC=C(C=C3)Br
InChI=1SC16H14BrN3Sc17137914(10813)2015(181916(20)21)116124213512h15710H611H2(H1921)
MFCD04055356
ZINC000006402865
ZINC06402865
ZINC6402865
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