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6-butyl-4-methyl-7-(3-methylphenyl)purino[7,8-a]imidazole-1,3-dione

6-butyl-4-methyl-7-(3-methylphenyl)purino[7,8-a]imidazole-1,3-dione

Systemtic Name:6-butyl-4-methyl-7-(3-methylphenyl)purino[7,8-a]imidazole-1,3-dione
Openeye Name:6-butyl-4-methyl-7-(m-tolyl)purino[7,8-a]imidazole-1,3-dione
CAS Name:6-butyl-4-methyl-7-(3-methylphenyl)purino[7,8-a]imidazole-1,3-dione
IUPAC Name:6-butyl-4-methyl-7-(3-methylphenyl)purino[7,8-a]imidazole-1,3-dione
Traditional Name:6-butyl-4-methyl-7-(m-tolyl)purin[7,8-a]imidazole-1,3-quinone
Formula: C19H21N5O2
MolecularWeight: 351.40234
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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=CN2C1=NC3=C2C(=O)NC(=O)N3C)C4=CC(=CC=C4)C


Isomeric SMILES

CCCCN1C(=CN2C1=NC3=C2C(=O)NC(=O)N3C)C4=CC(=CC=C4)C


InChI

InChI=1S/C19H21N5O2/c1-4-5-9-23-14(13-8-6-7-12(2)10-13)11-24-15-16(20-18(23)24)22(3)19(26)21-17(15)25/h6-8,10-11H,4-5,9H2,1-3H3,(H,21,25,26)


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