3-chloranyl-N-[(2S)-1-[4-(2-ethanoyl-1-ethyl-imidazol-4-yl)-3-fluoranyl-phenyl]-4-oxidanyl-butan-2-yl]-4-propan-2-yloxy-benzamide

Systemtic Name: 3-chloranyl-N-[(2S)-1-[4-(2-ethanoyl-1-ethyl-imidazol-4-yl)-3-fluoranyl-phenyl]-4-oxidanyl-butan-2-yl]-4-propan-2-yloxy-benzamide Openeye Name: N-[(1S)-1-[[4-(2-acetyl-1-ethyl-imidazol-4-yl)-3-fluoro-phenyl]methyl]-3-hydroxy-propyl]-3-chloro-4-isopropoxy-benzamide CAS Name: N-[(2S)-1-[4-(2-acetyl-1-ethyl-4-imidazolyl)-3-fluorophenyl]-4-hydroxybutan-2-yl]-3-chloro-4-propan-2-yloxybenzamide IUPAC Name: N-[(2S)-1-[4-(2-acetyl-1-ethylimidazol-4-yl)-3-fluorophenyl]-4-hydroxybutan-2-yl]-3-chloro-4-propan-2-yloxybenzamide Traditional Name: N-[(1S)-1-[4-(2-acetyl-1-ethyl-imidazol-4-yl)-3-fluoro-benzyl]-3-hydroxy-propyl]-3-chloro-4-isopropoxy-benzamide Formula: C27H31ClFN3O4 MolecularWeight: 516.004143

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(N=C1C(=O)C)C2=C(C=C(C=C2)CC(CCO)NC(=O)C3=CC(=C(C=C3)OC(C)C)Cl)F

Isomeric SMILES

CCN1C=C(N=C1C(=O)C)C2=C(C=C(C=C2)C[C@@H](CCO)NC(=O)C3=CC(=C(C=C3)OC(C)C)Cl)F

InChI

InChI=1S/C27H31ClFN3O4/c1-5-32-15-24(31-26(32)17(4)34)21-8-6-18(13-23(21)29)12-20(10-11-33)30-27(35)19-7-9-25(22(28)14-19)36-16(2)3/h6-9,13-16,20,33H,5,10-12H2,1-4H3,(H,30,35)/t20-/m1/s1