9-[(4-methylphenyl)methyl]-1,3-dipropyl-7,8-dihydro-6H-purino[7,8-a]pyrimidine-2,4-dione

Systemtic Name: 9-[(4-methylphenyl)methyl]-1,3-dipropyl-7,8-dihydro-6H-purino[7,8-a]pyrimidine-2,4-dione Openeye Name: 1,3-dipropyl-9-(p-tolylmethyl)-7,8-dihydro-6H-purino[7,8-a]pyrimidine-2,4-dione CAS Name: 9-[(4-methylphenyl)methyl]-1,3-dipropyl-7,8-dihydro-6H-purino[7,8-a]pyrimidine-2,4-dione IUPAC Name: 9-[(4-methylphenyl)methyl]-1,3-dipropyl-7,8-dihydro-6H-purino[7,8-a]pyrimidine-2,4-dione Traditional Name: 9-(4-methylbenzyl)-1,3-dipropyl-7,8-dihydro-6H-purino[7,8-a]pyrimidine-2,4-quinone Formula: C22H29N5O2 MolecularWeight: 395.49796

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C(=O)N(C1=O)CCC)N3CCCN(C3=N2)CC4=CC=C(C=C4)C

Isomeric SMILES

CCCN1C2=C(C(=O)N(C1=O)CCC)N3CCCN(C3=N2)CC4=CC=C(C=C4)C

InChI

InChI=1S/C22H29N5O2/c1-4-11-26-19-18(20(28)27(12-5-2)22(26)29)25-14-6-13-24(21(25)23-19)15-17-9-7-16(3)8-10-17/h7-10H,4-6,11-15H2,1-3H3