4-(1H-indol-5-ylcarbonyl)-1-phenethyl-6-(pyridin-4-ylmethoxy)-1,4-diazepan-2-one

Systemtic Name: 4-(1H-indol-5-ylcarbonyl)-1-phenethyl-6-(pyridin-4-ylmethoxy)-1,4-diazepan-2-one Openeye Name: 4-(1H-indole-5-carbonyl)-1-phenethyl-6-(4-pyridylmethoxy)-1,4-diazepan-2-one CAS Name: 4-[1H-indol-5-yl(oxo)methyl]-1-phenethyl-6-(pyridin-4-ylmethoxy)-1,4-diazepan-2-one IUPAC Name: 4-(1H-indole-5-carbonyl)-1-phenethyl-6-(pyridin-4-ylmethoxy)-1,4-diazepan-2-one Traditional Name: 4-(1H-indole-5-carbonyl)-1-phenethyl-6-(4-pyridylmethoxy)-1,4-diazepan-2-one Formula: C28H28N4O3 MolecularWeight: 468.54692

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CN(C(=O)CN1C(=O)C2=CC3=C(C=C2)NC=C3)CCC4=CC=CC=C4)OCC5=CC=NC=C5

Isomeric SMILES

C1C(CN(C(=O)CN1C(=O)C2=CC3=C(C=C2)NC=C3)CCC4=CC=CC=C4)OCC5=CC=NC=C5

InChI

InChI=1S/C28H28N4O3/c33-27-19-32(28(34)24-6-7-26-23(16-24)10-14-30-26)18-25(35-20-22-8-12-29-13-9-22)17-31(27)15-11-21-4-2-1-3-5-21/h1-10,12-14,16,25,30H,11,15,17-20H2