8-[furan-2-ylmethyl-[(4-methoxyphenyl)methyl]amino]-1,3-dimethyl-7H-purine-2,6-dione

Systemtic Name: 8-[furan-2-ylmethyl-[(4-methoxyphenyl)methyl]amino]-1,3-dimethyl-7H-purine-2,6-dione Openeye Name: 8-[2-furylmethyl-[(4-methoxyphenyl)methyl]amino]-1,3-dimethyl-7H-purine-2,6-dione CAS Name: 8-[2-furanylmethyl-[(4-methoxyphenyl)methyl]amino]-1,3-dimethyl-7H-purine-2,6-dione IUPAC Name: 8-[furan-2-ylmethyl-[(4-methoxyphenyl)methyl]amino]-1,3-dimethyl-7H-purine-2,6-dione Traditional Name: 8-[2-furfuryl(p-anisyl)amino]-1,3-dimethyl-7H-purine-2,6-quinone Formula: C20H21N5O4 MolecularWeight: 395.41184

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)NC(=N2)N(CC3=CC=C(C=C3)OC)CC4=CC=CO4

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)NC(=N2)N(CC3=CC=C(C=C3)OC)CC4=CC=CO4

InChI

InChI=1S/C20H21N5O4/c1-23-17-16(18(26)24(2)20(23)27)21-19(22-17)25(12-15-5-4-10-29-15)11-13-6-8-14(28-3)9-7-13/h4-10H,11-12H2,1-3H3,(H,21,22)