6-[3-(dimethylamino)propyl]-4-(3-nitrophenyl)-2-phenyl-7H-pyrrolo[3,4-d]pyrimidin-5-one

Systemtic Name: 6-[3-(dimethylamino)propyl]-4-(3-nitrophenyl)-2-phenyl-7H-pyrrolo[3,4-d]pyrimidin-5-one Openeye Name: 6-[3-(dimethylamino)propyl]-4-(3-nitrophenyl)-2-phenyl-7H-pyrrolo[3,4-d]pyrimidin-5-one CAS Name: 6-[3-(dimethylamino)propyl]-4-(3-nitrophenyl)-2-phenyl-7H-pyrrolo[3,4-d]pyrimidin-5-one IUPAC Name: 6-[3-(dimethylamino)propyl]-4-(3-nitrophenyl)-2-phenyl-7H-pyrrolo[3,4-d]pyrimidin-5-one Traditional Name: 6-[3-(dimethylamino)propyl]-4-(3-nitrophenyl)-2-phenyl-7H-pyrrolo[3,4-d]pyrimidin-5-one Formula: C23H23N5O3 MolecularWeight: 417.46042

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCCN1CC2=NC(=NC(=C2C1=O)C3=CC(=CC=C3)[N+](=O)[O-])C4=CC=CC=C4

Isomeric SMILES

CN(C)CCCN1CC2=NC(=NC(=C2C1=O)C3=CC(=CC=C3)[N+](=O)[O-])C4=CC=CC=C4

InChI

InChI=1S/C23H23N5O3/c1-26(2)12-7-13-27-15-19-20(23(27)29)21(17-10-6-11-18(14-17)28(30)31)25-22(24-19)16-8-4-3-5-9-16/h3-6,8-11,14H,7,12-13,15H2,1-2H3