Vitas-M small molecule compound
4-(4-ethoxyphenyl)-3-(4-methoxyphenyl)-5-{[(2E)-3-phenylprop-2-en-1-yl]sulfanyl}-4H-1,2,4-triazole
Catalog ID
STK595635
SMILES CCOc1ccc(cc1)n1c(SC/C=C/c2ccccc2)nnc1c1ccc(cc1)OC
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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 C26H25N3O2S MW 443.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H25N3O2S/c1-3-31-24-17-13-22(14-18-24)29-25(21-11-15-23(30-2)16-12-21)27-28-26(29)32-19-7-10-20-8-5-4-6-9-20/h4-18H,3,19H2,1-2H3/b10-7+InChIKey
GZCSYRLRXXMFTQ-JXMROGBWSA-NSynonyms
899394-18-41(5((2E)3PHENYLPROP2ENYLTHIO)4(4ETHOXYPHENYL)(124TRIAZOL3YL))4METHOXYBENZENE
3(cinnamylthio)4(4ethoxyphenyl)5(4methoxyphenyl)4H124triazole
4(4ethoxyphenyl)3(4methoxyphenyl)5(((2E)3phenylprop2en1yl)sulfanyl)4H124triazole
4(4ETHOXYPHENYL)3(4METHOXYPHENYL)5((E)3PHENYLPROP2ENYL)SULFANYL124TRIAZOLE
899394184
CCOC1=CC=C(C=C1)N2C(=NN=C2SCC=CC3=CC=CC=C3)C4=CC=C(C=C4)OC
CCOc1ccc(cc1)n1c(SCC=Cc2ccccc2)nnc1c1ccc(cc1)OC
InChI=1SC26H25N3O2Sc133124171322(141824)2925(21111523(302)161221)272826(29)3219710208546920h418H319H212H3b107+
MFCD06607860
ZINC000002337940
ZINC02337940
ZINC2337940
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