ethyl 4-[1-[[2-(4-tert-butyl-1,3-thiazol-2-yl)-1-benzofuran-5-yl]methyl]-3-methanoyl-indol-5-yl]oxybutanoate

Systemtic Name: ethyl 4-[1-[[2-(4-tert-butyl-1,3-thiazol-2-yl)-1-benzofuran-5-yl]methyl]-3-methanoyl-indol-5-yl]oxybutanoate Openeye Name: ethyl 4-[1-[[2-(4-tert-butylthiazol-2-yl)benzofuran-5-yl]methyl]-3-formyl-indol-5-yl]oxybutanoate CAS Name: 4-[[1-[[2-(4-tert-butyl-2-thiazolyl)-5-benzofuranyl]methyl]-3-formyl-5-indolyl]oxy]butanoic acid ethyl ester IUPAC Name: ethyl 4-[1-[[2-(4-tert-butyl-1,3-thiazol-2-yl)-1-benzofuran-5-yl]methyl]-3-formylindol-5-yl]oxybutanoate Traditional Name: 4-[1-[[2-(4-tert-butylthiazol-2-yl)benzofuran-5-yl]methyl]-3-formyl-indol-5-yl]oxybutyric acid ethyl ester Formula: C31H32N2O5S MolecularWeight: 544.66118

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCOC1=CC2=C(C=C1)N(C=C2C=O)CC3=CC4=C(C=C3)OC(=C4)C5=NC(=CS5)C(C)(C)C

Isomeric SMILES

CCOC(=O)CCCOC1=CC2=C(C=C1)N(C=C2C=O)CC3=CC4=C(C=C3)OC(=C4)C5=NC(=CS5)C(C)(C)C

InChI

InChI=1S/C31H32N2O5S/c1-5-36-29(35)7-6-12-37-23-9-10-25-24(15-23)22(18-34)17-33(25)16-20-8-11-26-21(13-20)14-27(38-26)30-32-28(19-39-30)31(2,3)4/h8-11,13-15,17-19H,5-7,12,16H2,1-4H3