Vitas-M small molecule compound
4-(3-chloro-2-methylphenyl)-5-{[(2-methylbenzyl)sulfanyl]methyl}-4H-1,2,4-triazole-3-thiol
Catalog ID
STK445648
SMILES Sc1nnc(n1c1cccc(c1C)Cl)CSCc1ccccc1C
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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/c1-12-6-3-4-7-14(12)10-24-11-17-20-21-18(23)22(17)16-9-5-8-15(19)13(16)2/h3-9H,10-11H2,1-2H3,(H,21,23)InChIKey
DBWALNIKMBMPDI-UHFFFAOYSA-NSynonyms
4(3chloro2methylphenyl)3((2methylphenyl)methylsulfanylmethyl)1H124triazole5thione
4(3chloro2methylphenyl)5(((2methylbenzyl)sulfanyl)methyl)4H124triazole3thiol
4(3CHLORO2METHYLPHENYL)5(((2METHYLPHENYL)METHYLTHIO)METHYL)124TRIAZOLE3THIOL
CC1=CC=CC=C1CSCC2=NNC(=S)N2C3=C(C(=CC=C3)Cl)C
InChI=1SC18H18ClN3S2c112634714(12)10241117202118(23)22(17)1695815(19)13(16)2h39H1011H212H3(H2123)
MFCD04057958
ZINC000006401714
ZINC06401714
ZINC6401714
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