Vitas-M small molecule compound
4-[2-(3,4-diethoxyphenyl)ethyl]-5-{5-[(4-ethylphenoxy)methyl]furan-2-yl}-4H-1,2,4-triazole-3-thiol
Catalog ID
STK307457
SMILES CCOc1cc(CCn2c(S)nnc2c2ccc(o2)COc2ccc(cc2)CC)ccc1OCC
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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 C27H31N3O4S MW 493.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H31N3O4S/c1-4-19-7-10-21(11-8-19)33-18-22-12-14-24(34-22)26-28-29-27(35)30(26)16-15-20-9-13-23(31-5-2)25(17-20)32-6-3/h7-14,17H,4-6,15-16,18H2,1-3H3,(H,29,35)InChIKey
XZFRQFXBIUBGDB-UHFFFAOYSA-NSynonyms
828292-31-54(2(34DIETHOXYPHENYL)ETHYL)3(5((4ETHYLPHENOXY)METHYL)FURAN2YL)1H124TRIAZOLE5THIONE
4(2(34diethoxyphenyl)ethyl)5(5((4ethylphenoxy)methyl)furan2yl)4H124triazole3thiol
828292315
CCC1=CC=C(C=C1)OCC2=CC=C(O2)C3=NNC(=S)N3CCC4=CC(=C(C=C4)OCC)OCC
InChI=1SC27H31N3O4Sc141971021(11819)331822121424(3422)26282927(35)30(26)16152091323(3152)25(1720)3263h71417H46151618H213H3(H2935)
MFCD04052720
ZINC000002793678
ZINC02793678
ZINC2793678
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