Vitas-M small molecule compound
4-{[(E)-(4-ethoxy-3-methoxyphenyl)methylidene]amino}-5-[3-(propan-2-yloxy)phenyl]-2,4-dihydro-3H-1,2,4-triazole-3-thione
Catalog ID
STK585077
SMILES CCOc1ccc(cc1OC)/C=N/n1c(=S)[nH]nc1c1cccc(c1)OC(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 C21H24N4O3S MW 412.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H24N4O3S/c1-5-27-18-10-9-15(11-19(18)26-4)13-22-25-20(23-24-21(25)29)16-7-6-8-17(12-16)28-14(2)3/h6-14H,5H2,1-4H3,(H,24,29)/b22-13+InChIKey
VKJMVDROIKHLCX-LPYMAVHISA-NSynonyms
573941-64-74(((E)(4ethoxy3methoxyphenyl)methylidene)amino)5(3(propan2yloxy)phenyl)24dihydro3H124triazole3thione
4((1E)2(4ETHOXY3METHOXYPHENYL)1AZAVINYL)5(3(METHYLETHOXY)PHENYL)124TRIAZOLE3THIOL
4((E)(4ETHOXY3METHOXYPHENYL)METHYLIDENEAMINO)3(3PROPAN2YLOXYPHENYL)1H124TRIAZOLE5THIONE
573941647
CCOC1=C(C=C(C=C1)C=NN2C(=NNC2=S)C3=CC(=CC=C3)OC(C)C)OC
CCOc1ccc(cc1OC)C=Nn1c(=S)(nH)nc1c1cccc(c1)OC(C)C
InChI=1SC21H24N4O3Sc15271810915(1119(18)264)13222520(232421(25)29)1676817(1216)2814(2)3h614H5H214H3(H2429)b2213+
MFCD07207862
ZINC000005900503
ZINC2220420
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