1-[(2-aminophenyl)methyl]-3-(2-methylphenyl)-7H-purine-2,6-dione

Systemtic Name: 1-[(2-aminophenyl)methyl]-3-(2-methylphenyl)-7H-purine-2,6-dione Openeye Name: 1-[(2-aminophenyl)methyl]-3-(o-tolyl)-7H-purine-2,6-dione CAS Name: 1-[(2-aminophenyl)methyl]-3-(2-methylphenyl)-7H-purine-2,6-dione IUPAC Name: 1-[(2-aminophenyl)methyl]-3-(2-methylphenyl)-7H-purine-2,6-dione Traditional Name: 1-(2-aminobenzyl)-3-(o-tolyl)-7H-purine-2,6-quinone Formula: C19H17N5O2 MolecularWeight: 347.37058

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C3=C(C(=O)N(C2=O)CC4=CC=CC=C4N)NC=N3

Isomeric SMILES

CC1=CC=CC=C1N2C3=C(C(=O)N(C2=O)CC4=CC=CC=C4N)NC=N3

InChI

InChI=1S/C19H17N5O2/c1-12-6-2-5-9-15(12)24-17-16(21-11-22-17)18(25)23(19(24)26)10-13-7-3-4-8-14(13)20/h2-9,11H,10,20H2,1H3,(H,21,22)