Vitas-M small molecule compound

5-[(2,6-dimethylphenoxy)methyl]-4-(4-methylphenyl)-4H-1,2,4-triazole-3-thiol

Catalog ID
STK197863
SMILES Cc1ccc(cc1)n1c(nnc1S)COc1c(C)cccc1C

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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 C18H19N3OS MW 325.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H19N3OS/c1-12-7-9-15(10-8-12)21-16(19-20-18(21)23)11-22-17-13(2)5-4-6-14(17)3/h4-10H,11H2,1-3H3,(H,20,23)
InChIKey
VHDOWMQEZZFDFI-UHFFFAOYSA-N
Synonyms
64013-55-4
3((26DIMETHYLPHENOXY)METHYL)4(4METHYLPHENYL)1H124TRIAZOLE5THIONE
3H124TRIAZOLE3THIONE5((26DIMETHYLPHENOXY)METHYL)24DIHYDRO4(4METHYLPHENYL)
5((26DIMETHYLPHENOXY)METHYL)4(4METHYLPHENYL)4H124TRIAZOLE3THIOL
5(26DIMETHYLPHENOXYMETHYL)4PTOLYL4H(124)TRIAZOLE3THIOL
64013554
CC1=CC=C(C=C1)N2C(=NNC2=S)COC3=C(C=CC=C3C)C
InChI=1SC18H19N3OSc1127915(10812)2116(192018(21)23)11221713(2)54614(17)3h410H11H213H3(H2023)
MFCD06665936
ZINC000017125347
ZINC17125347

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Available files

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