(phenylmethyl) 4-oxidanylidene-1-[2-oxidanylidene-1-phenyl-2-(7H-pyrrolo[3,4-d]pyrimidin-7-ylmethylamino)ethyl]azetidine-2-carboxylate

Systemtic Name: (phenylmethyl) 4-oxidanylidene-1-[2-oxidanylidene-1-phenyl-2-(7H-pyrrolo[3,4-d]pyrimidin-7-ylmethylamino)ethyl]azetidine-2-carboxylate Openeye Name: benzyl 4-oxo-1-[2-oxo-1-phenyl-2-(7H-pyrrolo[3,4-d]pyrimidin-7-ylmethylamino)ethyl]azetidine-2-carboxylate CAS Name: 4-oxo-1-[2-oxo-1-phenyl-2-(7H-pyrrolo[3,4-d]pyrimidin-7-ylmethylamino)ethyl]-2-azetidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 4-oxo-1-[2-oxo-1-phenyl-2-(7H-pyrrolo[3,4-d]pyrimidin-7-ylmethylamino)ethyl]azetidine-2-carboxylate Traditional Name: 4-keto-1-[2-keto-1-phenyl-2-(7H-pyrrolo[3,4-d]pyrimidin-7-ylmethylamino)ethyl]azetidine-2-carboxylic acid benzyl ester Formula: C26H23N5O4 MolecularWeight: 469.49192

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Descriptors Computed from Structure

Canonical SMILES:

C1C(N(C1=O)C(C2=CC=CC=C2)C(=O)NCC3C4=NC=NC=C4C=N3)C(=O)OCC5=CC=CC=C5

Isomeric SMILES

C1C(N(C1=O)C(C2=CC=CC=C2)C(=O)NCC3C4=NC=NC=C4C=N3)C(=O)OCC5=CC=CC=C5

InChI

InChI=1S/C26H23N5O4/c32-22-11-21(26(34)35-15-17-7-3-1-4-8-17)31(22)24(18-9-5-2-6-10-18)25(33)29-14-20-23-19(13-28-20)12-27-16-30-23/h1-10,12-13,16,20-21,24H,11,14-15H2,(H,29,33)