Vitas-M small molecule compound
5-benzyl-4-(4-ethoxyphenyl)-4H-1,2,4-triazole-3-thiol
Catalog ID
STK415335
SMILES CCOc1ccc(cc1)n1c(S)nnc1Cc1ccccc1
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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/c1-2-21-15-10-8-14(9-11-15)20-16(18-19-17(20)22)12-13-6-4-3-5-7-13/h3-11H,2,12H2,1H3,(H,19,22)InChIKey
JLHGCWSCKHHSEX-UHFFFAOYSA-NSynonyms
519152-03-53BENZYL4(4ETHOXYPHENYL)1H124TRIAZOLE5THIONE
4(4ETHOXYPHENYL)5BENZYL124TRIAZOLE3THIOL
519152035
5BENZYL4(4ETHOXYPHENYL)4H
5BENZYL4(4ETHOXYPHENYL)4H(124)TRIAZOLE3THIOL
5benzyl4(4ethoxyphenyl)4H124triazole3thiol
CCOC1=CC=C(C=C1)N2C(=NNC2=S)CC3=CC=CC=C3
InChI=1SC17H17N3OSc12211510814(91115)2016(181917(20)22)12136435713h311H212H21H3(H1922)
MFCD03479997
ZINC000005781697
ZINC05781697
ZINC5781697
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