1-(2-methylpropyl)-6-(naphthalen-1-ylmethyl)pyrrolo[3,4-d]pyrimidine-2,4-dione

Systemtic Name: 1-(2-methylpropyl)-6-(naphthalen-1-ylmethyl)pyrrolo[3,4-d]pyrimidine-2,4-dione Openeye Name: 1-isobutyl-6-(1-naphthylmethyl)pyrrolo[3,4-d]pyrimidine-2,4-dione CAS Name: 1-(2-methylpropyl)-6-(1-naphthalenylmethyl)pyrrolo[3,4-d]pyrimidine-2,4-dione IUPAC Name: 1-(2-methylpropyl)-6-(naphthalen-1-ylmethyl)pyrrolo[3,4-d]pyrimidine-2,4-dione Traditional Name: 1-isobutyl-6-(1-naphthylmethyl)pyrrolo[3,4-d]pyrimidine-2,4-quinone Formula: C21H21N3O2 MolecularWeight: 347.41034

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C2=CN(C=C2C(=O)NC1=O)CC3=CC=CC4=CC=CC=C43

Isomeric SMILES

CC(C)CN1C2=CN(C=C2C(=O)NC1=O)CC3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C21H21N3O2/c1-14(2)10-24-19-13-23(12-18(19)20(25)22-21(24)26)11-16-8-5-7-15-6-3-4-9-17(15)16/h3-9,12-14H,10-11H2,1-2H3,(H,22,25,26)