Vitas-M small molecule compound
5-[(3-methylphenoxy)methyl]-4-(2-methylphenyl)-4H-1,2,4-triazole-3-thiol
Catalog ID
STL232855
SMILES Cc1cccc(c1)OCc1nnc(n1c1ccccc1C)S
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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 C17H17N3OS MW 311.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H17N3OS/c1-12-6-5-8-14(10-12)21-11-16-18-19-17(22)20(16)15-9-4-3-7-13(15)2/h3-10H,11H2,1-2H3,(H,19,22)InChIKey
CPAYDZJVZOLVBO-UHFFFAOYSA-NSynonyms
328556-69-03((3METHYLPHENOXY)METHYL)4(2METHYLPHENYL)1H124TRIAZOLE5THIONE
328556690
4(otolyl)5((mtolyloxy)methyl)4H124triazole3thiol
4OTOLYL5MTOLYLOXYMETHYL4H(124)TRIAZOLE3THIOL
5((3methylphenoxy)methyl)4(2methylphenyl)4H124triazole3thiol
CC1=CC(=CC=C1)OCC2=NNC(=S)N2C3=CC=CC=C3C
InChI=1SC17H17N3OSc11265814(1012)211116181917(22)20(16)15943713(15)2h310H11H212H3(H1922)
MFCD01408790
ZINC000005687816
ZINC5687816
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