Vitas-M small molecule compound
4-({(E)-[4-(dimethylamino)phenyl]methylidene}amino)-5-(3,4,5-trimethoxyphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Catalog ID
STK574916
SMILES COc1cc(cc(c1OC)OC)c1n[nH]c(=S)n1/N=C/c1ccc(cc1)N(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 C20H23N5O3S MW 413.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H23N5O3S/c1-24(2)15-8-6-13(7-9-15)12-21-25-19(22-23-20(25)29)14-10-16(26-3)18(28-5)17(11-14)27-4/h6-12H,1-5H3,(H,23,29)/b21-12+InChIKey
CSQXADZDQPHMPC-CIAFOILYSA-NSynonyms
1233523-54-01233523540
4(((E)(4(dimethylamino)phenyl)methylidene)amino)5(345trimethoxyphenyl)24dihydro3H124triazole3thione
4((E)(4(dimethylamino)phenyl)methylideneamino)3(345trimethoxyphenyl)1H124triazole5thione
4((E)(4DIMETHYLAMINOPHENYL)METHYLIDENEAMINO)3(345TRIMETHOXYPHENYL)1H124TRIAZOLE5THIONE
CN(C)C1=CC=C(C=C1)C=NN2C(=NNC2=S)C3=CC(=C(C(=C3)OC)OC)OC
COc1cc(cc(c1OC)OC)c1n(nH)c(=S)n1N=Cc1ccc(cc1)N(C)C
InChI=1SC20H23N5O3Sc124(2)158613(7915)12212519(222320(25)29)141016(263)18(285)17(1114)274h612H15H3(H2329)b2112+
MFCD00834428
ZINC000005328505
ZINC1476055
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