Vitas-M small molecule compound
4-{[(E)-(5-bromo-2-methoxyphenyl)methylidene]amino}-5-(3-chlorophenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Catalog ID
STK587890
SMILES COc1ccc(cc1/C=N/n1c(=S)[nH]nc1c1cccc(c1)Cl)Br
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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 C16H12BrClN4OS MW 423.72 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H12BrClN4OS/c1-23-14-6-5-12(17)7-11(14)9-19-22-15(20-21-16(22)24)10-3-2-4-13(18)8-10/h2-9H,1H3,(H,21,24)/b19-9+InChIKey
BUAONYVFOFZBSZ-DJKKODMXSA-NSynonyms
478254-73-84(((E)(5bromo2methoxyphenyl)methylidene)amino)5(3chlorophenyl)24dihydro3H124triazole3thione
4((1E)2(5BROMO2METHOXYPHENYL)1AZAVINYL)5(3CHLOROPHENYL)124TRIAZOLE3THIOL
4((5BROMO2METHOXYBENZYLIDENE)AMINO)3(3CHLOROPHENYL)1H124TRIAZOLE5(4H)THIONE
4((E)(5BROMO2METHOXYPHENYL)METHYLIDENEAMINO)3(3CHLOROPHENYL)1H124TRIAZOLE5THIONE
478254738
COC1=C(C=C(C=C1)Br)C=NN2C(=NNC2=S)C3=CC(=CC=C3)Cl
COc1ccc(cc1C=Nn1c(=S)(nH)nc1c1cccc(c1)Cl)Br
InChI=1SC16H12BrClN4OSc123146512(17)711(14)9192215(202116(22)24)1032413(18)810h29H1H3(H2124)b199+
MFCD07200170
ZINC000009109493
ZINC2233491
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