3-(3-methylphenyl)-1-propan-2-yl-7H-purine-2,6-dione

Systemtic Name: 3-(3-methylphenyl)-1-propan-2-yl-7H-purine-2,6-dione Openeye Name: 1-isopropyl-3-(m-tolyl)-7H-purine-2,6-dione CAS Name: 3-(3-methylphenyl)-1-propan-2-yl-7H-purine-2,6-dione IUPAC Name: 3-(3-methylphenyl)-1-propan-2-yl-7H-purine-2,6-dione Traditional Name: 1-isopropyl-3-(m-tolyl)-7H-purine-2,6-quinone Formula: C15H16N4O2 MolecularWeight: 284.31314

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C3=C(C(=O)N(C2=O)C(C)C)NC=N3

Isomeric SMILES

CC1=CC(=CC=C1)N2C3=C(C(=O)N(C2=O)C(C)C)NC=N3

InChI

InChI=1S/C15H16N4O2/c1-9(2)18-14(20)12-13(17-8-16-12)19(15(18)21)11-6-4-5-10(3)7-11/h4-9H,1-3H3,(H,16,17)