1,3-dimethyl-5-(4-methylphenyl)-6-(3-oxidanylpropyl)pyrrolo[3,4-d]pyrimidine-2,4-dione

Systemtic Name: 1,3-dimethyl-5-(4-methylphenyl)-6-(3-oxidanylpropyl)pyrrolo[3,4-d]pyrimidine-2,4-dione Openeye Name: 6-(3-hydroxypropyl)-1,3-dimethyl-5-(p-tolyl)pyrrolo[3,4-d]pyrimidine-2,4-dione CAS Name: 6-(3-hydroxypropyl)-1,3-dimethyl-5-(4-methylphenyl)pyrrolo[3,4-d]pyrimidine-2,4-dione IUPAC Name: 6-(3-hydroxypropyl)-1,3-dimethyl-5-(4-methylphenyl)pyrrolo[3,4-d]pyrimidine-2,4-dione Traditional Name: 6-(3-hydroxypropyl)-1,3-dimethyl-5-(p-tolyl)pyrrolo[3,4-d]pyrimidine-2,4-quinone Formula: C18H21N3O3 MolecularWeight: 327.37764

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C3C(=CN2CCCO)N(C(=O)N(C3=O)C)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=C3C(=CN2CCCO)N(C(=O)N(C3=O)C)C

InChI

InChI=1S/C18H21N3O3/c1-12-5-7-13(8-6-12)16-15-14(11-21(16)9-4-10-22)19(2)18(24)20(3)17(15)23/h5-8,11,22H,4,9-10H2,1-3H3