Vitas-M small molecule compound
4-{[(1E,2E)-3-(furan-2-yl)-2-methylprop-2-en-1-ylidene]amino}-5-(3,4,5-trimethoxyphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Catalog ID
STK574272
SMILES COc1cc(cc(c1OC)OC)c1n[nH]c(=S)n1/N=C/C(=C/c1ccco1)/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 C19H20N4O4S MW 400.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H20N4O4S/c1-12(8-14-6-5-7-27-14)11-20-23-18(21-22-19(23)28)13-9-15(24-2)17(26-4)16(10-13)25-3/h5-11H,1-4H3,(H,22,28)/b12-8+,20-11+InChIKey
NSKOQDGZUQPONN-RKHLGMAXSA-NSynonyms
487026-28-84(((1E2E)3(furan2yl)2methylprop2en1ylidene)amino)5(345trimethoxyphenyl)24dihydro3H124triazole3thione
4((1E3E)4(2FURYL)3METHYL1AZABUTA13DIENYL)5(345TRIMETHOXYPHENYL)124TRIAZOLE3THIOL
4((E)((E)3(furan2yl)2methylprop2enylidene)amino)3(345trimethoxyphenyl)1H124triazole5thione
487026288
CC(=CC1=CC=CO1)C=NN2C(=NNC2=S)C3=CC(=C(C(=C3)OC)OC)OC
COc1cc(cc(c1OC)OC)c1n(nH)c(=S)n1N=CC(=Cc1ccco1)C
InChI=1SC19H20N4O4Sc112(8146572714)11202318(212219(23)28)13915(242)17(264)16(1013)253h511H14H3(H2228)b128+2011+
MFCD07202097
ZINC000005665501
ZINC33303909
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