ethyl 3-[[2-(2-aminophenyl)-3-bromanyl-1-benzofuran-5-yl]methyl]-5-chloranyl-2-(2-methylpropyl)imidazole-4-carboxylate

Systemtic Name: ethyl 3-[[2-(2-aminophenyl)-3-bromanyl-1-benzofuran-5-yl]methyl]-5-chloranyl-2-(2-methylpropyl)imidazole-4-carboxylate Openeye Name: ethyl 3-[[2-(2-aminophenyl)-3-bromo-benzofuran-5-yl]methyl]-5-chloro-2-isobutyl-imidazole-4-carboxylate CAS Name: 3-[[2-(2-aminophenyl)-3-bromo-5-benzofuranyl]methyl]-5-chloro-2-(2-methylpropyl)-4-imidazolecarboxylic acid ethyl ester IUPAC Name: ethyl 3-[[2-(2-aminophenyl)-3-bromo-1-benzofuran-5-yl]methyl]-5-chloro-2-(2-methylpropyl)imidazole-4-carboxylate Traditional Name: 3-[[2-(2-aminophenyl)-3-bromo-benzofuran-5-yl]methyl]-5-chloro-2-isobutyl-imidazole-4-carboxylic acid ethyl ester Formula: C25H25BrClN3O3 MolecularWeight: 530.8413

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(N1CC2=CC3=C(C=C2)OC(=C3Br)C4=CC=CC=C4N)CC(C)C)Cl

Isomeric SMILES

CCOC(=O)C1=C(N=C(N1CC2=CC3=C(C=C2)OC(=C3Br)C4=CC=CC=C4N)CC(C)C)Cl

InChI

InChI=1S/C25H25BrClN3O3/c1-4-32-25(31)22-24(27)29-20(11-14(2)3)30(22)13-15-9-10-19-17(12-15)21(26)23(33-19)16-7-5-6-8-18(16)28/h5-10,12,14H,4,11,13,28H2,1-3H3