Vitas-M small molecule compound
4-(2-methylprop-2-en-1-yl)-5-(phenoxymethyl)-4H-1,2,4-triazole-3-thiol
Catalog ID
STL328222
SMILES CC(=C)Cn1c(COc2ccccc2)nnc1S
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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 C13H15N3OS MW 261.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H15N3OS/c1-10(2)8-16-12(14-15-13(16)18)9-17-11-6-4-3-5-7-11/h3-7H,1,8-9H2,2H3,(H,15,18)InChIKey
TXNWUQMHKIYXJK-UHFFFAOYSA-NSynonyms
328556-78-1328556781
4(2methylallyl)5(phenoxymethyl)4H124triazole3thiol
4(2METHYLALLYL)5PHENOXYMETHYL4H(124)TRIAZOLE3THIOL
4(2methylprop2en1yl)5(phenoxymethyl)4H124triazole3thiol
4(2METHYLPROP2ENYL)3(PHENOXYMETHYL)1H124TRIAZOLE5THIONE
4(2METHYLPROP2ENYL)5(PHENOXYMETHYL)124TRIAZOLE3THIOL
CC(=C)CN1C(=NNC1=S)COC2=CC=CC=C2
InChI=1SC13H15N3OSc110(2)81612(141513(16)18)917116435711h37H189H22H3(H1518)
MFCD00619000
ZINC000005685824
ZINC05685824
ZINC5685824
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