Vitas-M small molecule compound
5-(3-ethoxyphenyl)-4-{[(1E,2E)-2-methyl-3-phenylprop-2-en-1-ylidene]amino}-2,4-dihydro-3H-1,2,4-triazole-3-thione
Catalog ID
STK596514
SMILES CCOc1cccc(c1)c1n[nH]c(=S)n1/N=C/C(=C/c1ccccc1)/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 C20H20N4OS MW 364.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20N4OS/c1-3-25-18-11-7-10-17(13-18)19-22-23-20(26)24(19)21-14-15(2)12-16-8-5-4-6-9-16/h4-14H,3H2,1-2H3,(H,23,26)/b15-12+,21-14+InChIKey
PIPQOQNQDMNPSU-XBPMTVKWSA-NSynonyms
613249-69-73(3ethoxyphenyl)4((E)((E)2methyl3phenylprop2enylidene)amino)1H124triazole5thione
4((1E3E)3METHYL4PHENYL1AZABUTA13DIENYL)5(3ETHOXYPHENYL)124TRIAZOLE3THIOL
5(3ethoxyphenyl)4(((1E2E)2methyl3phenylprop2en1ylidene)amino)24dihydro3H124triazole3thione
613249697
CCOC1=CC=CC(=C1)C2=NNC(=S)N2N=CC(=CC3=CC=CC=C3)C
CCOc1cccc(c1)c1n(nH)c(=S)n1N=CC(=Cc1ccccc1)C
InChI=1SC20H20N4OSc1325181171017(1318)19222320(26)24(19)211415(2)12168546916h414H3H212H3(H2326)b1512+2114+
MFCD07202061
ZINC000005960213
ZINC33339848
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