Vitas-M small molecule compound
N-{(4E)-8-ethoxy-1,3-dimethyl-6-[4-(methylsulfanyl)phenyl]-4H-cyclohepta[c]furan-4-ylidene}-1,3-benzodioxol-5-amine
Catalog ID
STK628212
SMILES CCOc1cc(c/c(=N\c2ccc3c(c2)OCO3)/c2c1c(C)oc2C)c1ccc(cc1)SC
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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 C27H25NO4S MW 459.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H25NO4S/c1-5-29-25-13-19(18-6-9-21(33-4)10-7-18)12-22(26-16(2)32-17(3)27(25)26)28-20-8-11-23-24(14-20)31-15-30-23/h6-14H,5,15H2,1-4H3/b28-22+InChIKey
KRUQXUDXAANWAV-XAYXJRQQSA-NSynonyms
892625-84-2(E)N(8ethoxy13dimethyl6(4(methylthio)phenyl)4Hcyclohepta(c)furan4ylidene)benzo(d)(13)dioxol5amine
892625842
CCOc1cc(cc(=Nc2ccc3c(c2)OCO3)c2c1c(C)oc2C)c1ccc(cc1)SC
MFCD03849916
N((4E)8ethoxy13dimethyl6(4(methylsulfanyl)phenyl)4Hcyclohepta(c)furan4ylidene)13benzodioxol5amine
ZINC000009087905
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