tert-butyl 2-[4-[[3-methyl-5-(C-methylsulfanylcarbonimidoyl)-1-benzofuran-2-yl]carbonylamino]phenoxy]ethanoate

Systemtic Name: tert-butyl 2-[4-[[3-methyl-5-(C-methylsulfanylcarbonimidoyl)-1-benzofuran-2-yl]carbonylamino]phenoxy]ethanoate Openeye Name: tert-butyl 2-[4-[[3-methyl-5-(methylsulfanylcarbonimidoyl)benzofuran-2-carbonyl]amino]phenoxy]acetate CAS Name: 2-[4-[[[5-[imino-(methylthio)methyl]-3-methyl-2-benzofuranyl]-oxomethyl]amino]phenoxy]acetic acid tert-butyl ester IUPAC Name: tert-butyl 2-[4-[[3-methyl-5-(C-methylsulfanylcarbonimidoyl)-1-benzofuran-2-carbonyl]amino]phenoxy]acetate Traditional Name: 2-[4-[[3-methyl-5-[(methylthio)carbonimidoyl]benzofuran-2-carbonyl]amino]phenoxy]acetic acid tert-butyl ester Formula: C24H26N2O5S MolecularWeight: 454.53864

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C1C=C(C=C2)C(=N)SC)C(=O)NC3=CC=C(C=C3)OCC(=O)OC(C)(C)C

Isomeric SMILES

CC1=C(OC2=C1C=C(C=C2)C(=N)SC)C(=O)NC3=CC=C(C=C3)OCC(=O)OC(C)(C)C

InChI

InChI=1S/C24H26N2O5S/c1-14-18-12-15(22(25)32-5)6-11-19(18)30-21(14)23(28)26-16-7-9-17(10-8-16)29-13-20(27)31-24(2,3)4/h6-12,25H,13H2,1-5H3,(H,26,28)