Vitas-M small molecule compound
4-{[(E)-(5-methylthiophen-2-yl)methylidene]amino}-5-(3,4,5-trimethoxyphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Catalog ID
STK592357
SMILES COc1cc(cc(c1OC)OC)c1n[nH]c(=S)n1/N=C/c1ccc(s1)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 C17H18N4O3S2 MW 390.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H18N4O3S2/c1-10-5-6-12(26-10)9-18-21-16(19-20-17(21)25)11-7-13(22-2)15(24-4)14(8-11)23-3/h5-9H,1-4H3,(H,20,25)/b18-9+InChIKey
IMSFNIBSSBFBHK-GIJQJNRQSA-NSynonyms
496771-23-44(((E)(5methylthiophen2yl)methylidene)amino)5(345trimethoxyphenyl)24dihydro3H124triazole3thione
4((1E)2(5METHYL(2THIENYL))1AZAVINYL)5(345TRIMETHOXYPHENYL)124TRIAZOLE3THIOL
4((E)(5METHYLTHIOPHEN2YL)METHYLIDENEAMINO)3(345TRIMETHOXYPHENYL)1H124TRIAZOLE5THIONE
496771234
CC1=CC=C(S1)C=NN2C(=NNC2=S)C3=CC(=C(C(=C3)OC)OC)OC
COc1cc(cc(c1OC)OC)c1n(nH)c(=S)n1N=Cc1ccc(s1)C
InChI=1SC17H18N4O3S2c1105612(2610)9182116(192017(21)25)11713(222)15(244)14(811)233h59H14H3(H2025)b189+
MFCD07198308
ZINC000005602422
ZINC1088357
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