3-(6-azanyl-7H-purin-8-yl)-1-[6-(dimethylamino)naphthalen-2-yl]propan-1-one

Systemtic Name: 3-(6-azanyl-7H-purin-8-yl)-1-[6-(dimethylamino)naphthalen-2-yl]propan-1-one Openeye Name: 3-(6-amino-7H-purin-8-yl)-1-[6-(dimethylamino)-2-naphthyl]propan-1-one CAS Name: 3-(6-amino-7H-purin-8-yl)-1-[6-(dimethylamino)-2-naphthalenyl]-1-propanone IUPAC Name: 3-(6-amino-7H-purin-8-yl)-1-[6-(dimethylamino)naphthalen-2-yl]propan-1-one Traditional Name: 3-(6-amino-7H-purin-8-yl)-1-[6-(dimethylamino)-2-naphthyl]propan-1-one Formula: C20H20N6O MolecularWeight: 360.4124

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC2=C(C=C1)C=C(C=C2)C(=O)CCC3=NC4=C(N3)C(=NC=N4)N

Isomeric SMILES

CN(C)C1=CC2=C(C=C1)C=C(C=C2)C(=O)CCC3=NC4=C(N3)C(=NC=N4)N

InChI

InChI=1S/C20H20N6O/c1-26(2)15-6-5-12-9-14(4-3-13(12)10-15)16(27)7-8-17-24-18-19(21)22-11-23-20(18)25-17/h3-6,9-11H,7-8H2,1-2H3,(H3,21,22,23,24,25)