Vitas-M small molecule compound
5-(4-methoxybenzyl)-4-(2-methylphenyl)-4H-1,2,4-triazole-3-thiol
Catalog ID
STK332593
SMILES COc1ccc(cc1)Cc1nnc(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/c1-12-5-3-4-6-15(12)20-16(18-19-17(20)22)11-13-7-9-14(21-2)10-8-13/h3-10H,11H2,1-2H3,(H,19,22)InChIKey
ICYUZYJENOFEFR-UHFFFAOYSA-NSynonyms
627058-10-03((4METHOXYPHENYL)METHYL)4(2METHYLPHENYL)1H124TRIAZOLE5THIONE
5(4methoxybenzyl)4(2methylphenyl)4H124triazole3thiol
5(4methoxybenzyl)4(otolyl)4H124triazole3thiol
CC1=CC=CC=C1N2C(=NNC2=S)CC3=CC=C(C=C3)OC
InChI=1SC17H17N3OSc112534615(12)2016(181917(20)22)11137914(212)10813h310H11H212H3(H1922)
MFCD02854393
ZINC000005926965
ZINC5926965
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