3-(4-dimethylaminophenyl)-9-methyl-6-propyl-[1,2,4]triazolo[3,4-f]purin-5-one

Systemtic Name: 3-(4-dimethylaminophenyl)-9-methyl-6-propyl-[1,2,4]triazolo[3,4-f]purin-5-one Openeye Name: 3-(4-dimethylaminophenyl)-9-methyl-6-propyl-[1,2,4]triazolo[3,4-f]purin-5-one CAS Name: 3-(4-dimethylaminophenyl)-9-methyl-6-propyl-[1,2,4]triazolo[3,4-f]purin-5-one IUPAC Name: 3-(4-dimethylaminophenyl)-9-methyl-6-propyl-[1,2,4]triazolo[3,4-f]purin-5-one Traditional Name: 3-(4-dimethylaminophenyl)-9-methyl-6-propyl-[1,2,4]triazolo[3,4-f]purin-5-one Formula: C18H21N7O MolecularWeight: 351.40564

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C3=NN=C(N3C1=O)C4=CC=C(C=C4)N(C)C)N(C=N2)C

Isomeric SMILES

CCCN1C2=C(C3=NN=C(N3C1=O)C4=CC=C(C=C4)N(C)C)N(C=N2)C

InChI

InChI=1S/C18H21N7O/c1-5-10-24-16-14(23(4)11-19-16)17-21-20-15(25(17)18(24)26)12-6-8-13(9-7-12)22(2)3/h6-9,11H,5,10H2,1-4H3