1-(furan-2-ylmethyl)-3-(4-propan-2-ylphenyl)-7H-purine-2,6-dione

Systemtic Name: 1-(furan-2-ylmethyl)-3-(4-propan-2-ylphenyl)-7H-purine-2,6-dione Openeye Name: 1-(2-furylmethyl)-3-(4-isopropylphenyl)-7H-purine-2,6-dione CAS Name: 1-(2-furanylmethyl)-3-(4-propan-2-ylphenyl)-7H-purine-2,6-dione IUPAC Name: 1-(furan-2-ylmethyl)-3-(4-propan-2-ylphenyl)-7H-purine-2,6-dione Traditional Name: 1-(2-furfuryl)-3-p-cumenyl-7H-purine-2,6-quinone Formula: C19H18N4O3 MolecularWeight: 350.37122

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)N2C3=C(C(=O)N(C2=O)CC4=CC=CO4)NC=N3

Isomeric SMILES

CC(C)C1=CC=C(C=C1)N2C3=C(C(=O)N(C2=O)CC4=CC=CO4)NC=N3

InChI

InChI=1S/C19H18N4O3/c1-12(2)13-5-7-14(8-6-13)23-17-16(20-11-21-17)18(24)22(19(23)25)10-15-4-3-9-26-15/h3-9,11-12H,10H2,1-2H3,(H,20,21)