2-[2,4-bis(oxidanylidene)-1-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)-5-phenyl-1,3,5-benzotriazepin-3-yl]-N-phenyl-ethanamide

Systemtic Name: 2-[2,4-bis(oxidanylidene)-1-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)-5-phenyl-1,3,5-benzotriazepin-3-yl]-N-phenyl-ethanamide Openeye Name: 2-[2,4-dioxo-1-(2-oxo-2-pyrrolidin-1-yl-ethyl)-5-phenyl-1,3,5-benzotriazepin-3-yl]-N-phenyl-acetamide CAS Name: 2-[2,4-dioxo-1-[2-oxo-2-(1-pyrrolidinyl)ethyl]-5-phenyl-1,3,5-benzotriazepin-3-yl]-N-phenylacetamide IUPAC Name: 2-[2,4-dioxo-1-(2-oxo-2-pyrrolidin-1-ylethyl)-5-phenyl-1,3,5-benzotriazepin-3-yl]-N-phenylacetamide Traditional Name: 2-[2,4-diketo-1-(2-keto-2-pyrrolidino-ethyl)-5-phenyl-1,3,5-benzotriazepin-3-yl]-N-phenyl-acetamide Formula: C28H27N5O4 MolecularWeight: 497.54508

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)CN2C3=CC=CC=C3N(C(=O)N(C2=O)CC(=O)NC4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C1CCN(C1)C(=O)CN2C3=CC=CC=C3N(C(=O)N(C2=O)CC(=O)NC4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C28H27N5O4/c34-25(29-21-11-3-1-4-12-21)19-32-27(36)31(20-26(35)30-17-9-10-18-30)23-15-7-8-16-24(23)33(28(32)37)22-13-5-2-6-14-22/h1-8,11-16H,9-10,17-20H2,(H,29,34)