Vitas-M small molecule compound
4-[4-(butan-2-yl)phenyl]-5-{[(2-methylbenzyl)sulfanyl]methyl}-4H-1,2,4-triazole-3-thiol
Catalog ID
STK445598
SMILES CCC(c1ccc(cc1)n1c(CSCc2ccccc2C)nnc1S)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 C21H25N3S2 MW 383.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H25N3S2/c1-4-15(2)17-9-11-19(12-10-17)24-20(22-23-21(24)25)14-26-13-18-8-6-5-7-16(18)3/h5-12,15H,4,13-14H2,1-3H3,(H,23,25)InChIKey
ZJBCFRZRYWEQMH-UHFFFAOYSA-NSynonyms
4(4(butan2yl)phenyl)5(((2methylbenzyl)sulfanyl)methyl)4H124triazole3thiol
4(4butan2ylphenyl)3((2methylphenyl)methylsulfanylmethyl)1H124triazole5thione
5(((2METHYLPHENYL)METHYLTHIO)METHYL)4(4(METHYLPROPYL)PHENYL)124TRIAZOLE3THIOL
CCC(C)C1=CC=C(C=C1)N2C(=NNC2=S)CSCC3=CC=CC=C3C
InChI=1SC21H25N3S2c1415(2)1791119(121017)2420(222321(24)25)14261318865716(18)3h51215H41314H213H3(H2325)
MFCD04057881
ZINC000006394173
ZINC000006394391
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