Vitas-M small molecule compound
4-{[(E)-(4-tert-butylphenyl)methylidene]amino}-5-(4-chlorophenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Catalog ID
STL038083
SMILES Clc1ccc(cc1)c1n[nH]c(=S)n1/N=C/c1ccc(cc1)C(C)(C)C
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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 C19H19ClN4S MW 370.91 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H19ClN4S/c1-19(2,3)15-8-4-13(5-9-15)12-21-24-17(22-23-18(24)25)14-6-10-16(20)11-7-14/h4-12H,1-3H3,(H,23,25)/b21-12+InChIKey
ZPZFHGWBIQVNMC-CIAFOILYSA-NSynonyms
497083-98-44(((E)(4tertbutylphenyl)methylidene)amino)5(4chlorophenyl)24dihydro3H124triazole3thione
4((E)(4TERTBUTYLPHENYL)METHYLIDENEAMINO)3(4CHLOROPHENYL)1H124TRIAZOLE5THIONE
497083984
Clc1ccc(cc1)c1n(nH)c(=S)n1N=Cc1ccc(cc1)C(C)(C)C
InChI=1SC19H19ClN4Sc119(23)158413(5915)12212417(222318(24)25)1461016(20)11714h412H13H3(H2325)b2112+
MFCD03813337
ZINC000002356974
ZINC4679778
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