2,4-dimethyl-7-naphthalen-2-yl-6-(3-oxidanylpropyl)purino[7,8-a]imidazole-1,3-dione

Systemtic Name: 2,4-dimethyl-7-naphthalen-2-yl-6-(3-oxidanylpropyl)purino[7,8-a]imidazole-1,3-dione Openeye Name: 6-(3-hydroxypropyl)-2,4-dimethyl-7-(2-naphthyl)purino[7,8-a]imidazole-1,3-dione CAS Name: 6-(3-hydroxypropyl)-2,4-dimethyl-7-(2-naphthalenyl)purino[7,8-a]imidazole-1,3-dione IUPAC Name: 6-(3-hydroxypropyl)-2,4-dimethyl-7-naphthalen-2-ylpurino[7,8-a]imidazole-1,3-dione Traditional Name: 6-(3-hydroxypropyl)-2,4-dimethyl-7-(2-naphthyl)purin[7,8-a]imidazole-1,3-quinone Formula: C22H21N5O3 MolecularWeight: 403.43384

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)N3C=C(N(C3=N2)CCCO)C4=CC5=CC=CC=C5C=C4

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)N3C=C(N(C3=N2)CCCO)C4=CC5=CC=CC=C5C=C4

InChI

InChI=1S/C22H21N5O3/c1-24-19-18(20(29)25(2)22(24)30)27-13-17(26(10-5-11-28)21(27)23-19)16-9-8-14-6-3-4-7-15(14)12-16/h3-4,6-9,12-13,28H,5,10-11H2,1-2H3