1-[2-(2,4-dichlorophenyl)carbonyl-6-[(2S)-3-imidazol-1-yl-2-oxidanyl-propoxy]-1-benzofuran-3-yl]urea

Systemtic Name: 1-[2-(2,4-dichlorophenyl)carbonyl-6-[(2S)-3-imidazol-1-yl-2-oxidanyl-propoxy]-1-benzofuran-3-yl]urea Openeye Name: [2-(2,4-dichlorobenzoyl)-6-[(2S)-2-hydroxy-3-imidazol-1-yl-propoxy]benzofuran-3-yl]urea CAS Name: [2-[(2,4-dichlorophenyl)-oxomethyl]-6-[(2S)-2-hydroxy-3-(1-imidazolyl)propoxy]-3-benzofuranyl]urea IUPAC Name: [2-(2,4-dichlorobenzoyl)-6-[(2S)-2-hydroxy-3-imidazol-1-ylpropoxy]-1-benzofuran-3-yl]urea Traditional Name: [2-(2,4-dichlorobenzoyl)-6-[(2S)-2-hydroxy-3-imidazol-1-yl-propoxy]benzofuran-3-yl]urea Formula: C22H18Cl2N4O5 MolecularWeight: 489.30812

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1OCC(CN3C=CN=C3)O)OC(=C2NC(=O)N)C(=O)C4=C(C=C(C=C4)Cl)Cl

Isomeric SMILES

C1=CC2=C(C=C1OC[C@H](CN3C=CN=C3)O)OC(=C2NC(=O)N)C(=O)C4=C(C=C(C=C4)Cl)Cl

InChI

InChI=1S/C22H18Cl2N4O5/c23-12-1-3-15(17(24)7-12)20(30)21-19(27-22(25)31)16-4-2-14(8-18(16)33-21)32-10-13(29)9-28-6-5-26-11-28/h1-8,11,13,29H,9-10H2,(H3,25,27,31)/t13-/m0/s1