N-[1-azanyl-1-oxidanylidene-3-(5-oxidanyl-1H-indol-3-yl)propan-2-yl]-1-cyclohexyl-2-(2-fluoranyl-4-phenylmethoxy-phenyl)benzimidazole-5-carboxamide

Systemtic Name: N-[1-azanyl-1-oxidanylidene-3-(5-oxidanyl-1H-indol-3-yl)propan-2-yl]-1-cyclohexyl-2-(2-fluoranyl-4-phenylmethoxy-phenyl)benzimidazole-5-carboxamide Openeye Name: N-[2-amino-1-[(5-hydroxy-1H-indol-3-yl)methyl]-2-oxo-ethyl]-2-(4-benzyloxy-2-fluoro-phenyl)-1-cyclohexyl-benzimidazole-5-carboxamide CAS Name: N-[1-amino-3-(5-hydroxy-1H-indol-3-yl)-1-oxopropan-2-yl]-1-cyclohexyl-2-(2-fluoro-4-phenylmethoxyphenyl)-5-benzimidazolecarboxamide IUPAC Name: N-[1-amino-3-(5-hydroxy-1H-indol-3-yl)-1-oxopropan-2-yl]-1-cyclohexyl-2-(2-fluoro-4-phenylmethoxyphenyl)benzimidazole-5-carboxamide Traditional Name: N-[2-amino-1-[(5-hydroxy-1H-indol-3-yl)methyl]-2-keto-ethyl]-2-(4-benzoxy-2-fluoro-phenyl)-1-cyclohexyl-benzimidazole-5-carboxamide Formula: C38H36FN5O4 MolecularWeight: 645.721943

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2C3=C(C=C(C=C3)C(=O)NC(CC4=CNC5=C4C=C(C=C5)O)C(=O)N)N=C2C6=C(C=C(C=C6)OCC7=CC=CC=C7)F

Isomeric SMILES

C1CCC(CC1)N2C3=C(C=C(C=C3)C(=O)NC(CC4=CNC5=C4C=C(C=C5)O)C(=O)N)N=C2C6=C(C=C(C=C6)OCC7=CC=CC=C7)F

InChI

InChI=1S/C38H36FN5O4/c39-31-20-28(48-22-23-7-3-1-4-8-23)13-14-29(31)37-42-33-17-24(11-16-35(33)44(37)26-9-5-2-6-10-26)38(47)43-34(36(40)46)18-25-21-41-32-15-12-27(45)19-30(25)32/h1,3-4,7-8,11-17,19-21,26,34,41,45H,2,5-6,9-10,18,22H2,(H2,40,46)(H,43,47)