Vitas-M small molecule compound
4-(5-chloro-2-methylphenyl)-5-{[(2-methylbenzyl)sulfanyl]methyl}-4H-1,2,4-triazole-3-thiol
Catalog ID
STK445596
SMILES Clc1ccc(c(c1)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 C18H18ClN3S2 MW 375.95 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18ClN3S2/c1-12-5-3-4-6-14(12)10-24-11-17-20-21-18(23)22(17)16-9-15(19)8-7-13(16)2/h3-9H,10-11H2,1-2H3,(H,21,23)InChIKey
WVSBTROQOPCWTC-UHFFFAOYSA-NSynonyms
4(5chloro2methylphenyl)3((2methylphenyl)methylsulfanylmethyl)1H124triazole5thione
4(5chloro2methylphenyl)5(((2methylbenzyl)sulfanyl)methyl)4H124triazole3thiol
4(5CHLORO2METHYLPHENYL)5(((2METHYLPHENYL)METHYLTHIO)METHYL)124TRIAZOLE3THIOL
CC1=C(C=C(C=C1)Cl)N2C(=NNC2=S)CSCC3=CC=CC=C3C
InChI=1SC18H18ClN3S2c112534614(12)10241117202118(23)22(17)16915(19)8713(16)2h39H1011H212H3(H2123)
MFCD04057694
ZINC000006401674
ZINC06401674
ZINC6401674
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