Vitas-M small molecule compound
4-{[(E)-{3-[(4-iodophenoxy)methyl]-4-methoxyphenyl}methylidene]amino}-5-methyl-4H-1,2,4-triazole-3-thiol
Catalog ID
STK306593
SMILES COc1ccc(cc1COc1ccc(cc1)I)/C=N/n1c(C)nnc1S
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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 C18H17IN4O2S MW 480.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H17IN4O2S/c1-12-21-22-18(26)23(12)20-10-13-3-8-17(24-2)14(9-13)11-25-16-6-4-15(19)5-7-16/h3-10H,11H2,1-2H3,(H,22,26)/b20-10+InChIKey
VHIOURYIYZAHPD-KEBDBYFISA-NSynonyms
828281-24-94(((E)(3((4iodophenoxy)methyl)4methoxyphenyl)methylidene)amino)5methyl4H124triazole3thiol
4((E)(3((4iodophenoxy)methyl)4methoxyphenyl)methylideneamino)3methyl1H124triazole5thione
828281249
CC1=NNC(=S)N1N=CC2=CC(=C(C=C2)OC)COC3=CC=C(C=C3)I
COc1ccc(cc1COc1ccc(cc1)I)C=Nn1c(C)nnc1S
InChI=1SC18H17IN4O2Sc112212218(26)23(12)2010133817(242)14(913)1125166415(19)5716h310H11H212H3(H2226)b2010+
MFCD04047908
ZINC000002791204
ZINC35679213
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