methyl 2-ethyl-3-[3-ethynyl-2-[2-[(2-methylpropan-2-yl)oxycarbonylamino]phenyl]-1-benzofuran-5-yl]-1,2-dihydroimidazole-5-carboxylate

Systemtic Name: methyl 2-ethyl-3-[3-ethynyl-2-[2-[(2-methylpropan-2-yl)oxycarbonylamino]phenyl]-1-benzofuran-5-yl]-1,2-dihydroimidazole-5-carboxylate Openeye Name: methyl 3-[2-[2-(tert-butoxycarbonylamino)phenyl]-3-ethynyl-benzofuran-5-yl]-2-ethyl-1,2-dihydroimidazole-5-carboxylate CAS Name: 2-ethyl-3-[3-ethynyl-2-[2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]phenyl]-5-benzofuranyl]-1,2-dihydroimidazole-5-carboxylic acid methyl ester IUPAC Name: methyl 2-ethyl-3-[3-ethynyl-2-[2-[(2-methylpropan-2-yl)oxycarbonylamino]phenyl]-1-benzofuran-5-yl]-1,2-dihydroimidazole-5-carboxylate Traditional Name: 1-[2-[2-(tert-butoxycarbonylamino)phenyl]-3-ethynyl-benzofuran-5-yl]-2-ethyl-4-imidazoline-4-carboxylic acid methyl ester Formula: C28H29N3O5 MolecularWeight: 487.54696

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Descriptors Computed from Structure

Canonical SMILES:

CCC1NC(=CN1C2=CC3=C(C=C2)OC(=C3C#C)C4=CC=CC=C4NC(=O)OC(C)(C)C)C(=O)OC

Isomeric SMILES

CCC1NC(=CN1C2=CC3=C(C=C2)OC(=C3C#C)C4=CC=CC=C4NC(=O)OC(C)(C)C)C(=O)OC

InChI

InChI=1S/C28H29N3O5/c1-7-18-20-15-17(31-16-22(26(32)34-6)29-24(31)8-2)13-14-23(20)35-25(18)19-11-9-10-12-21(19)30-27(33)36-28(3,4)5/h1,9-16,24,29H,8H2,2-6H3,(H,30,33)