3-(4-chlorophenyl)-1-ethyl-7-(phenylmethyl)-4,5-dihydropurine-2,6-dione

Systemtic Name: 3-(4-chlorophenyl)-1-ethyl-7-(phenylmethyl)-4,5-dihydropurine-2,6-dione Openeye Name: 7-benzyl-3-(4-chlorophenyl)-1-ethyl-4,5-dihydropurine-2,6-dione CAS Name: 3-(4-chlorophenyl)-1-ethyl-7-(phenylmethyl)-4,5-dihydropurine-2,6-dione IUPAC Name: 7-benzyl-3-(4-chlorophenyl)-1-ethyl-4,5-dihydropurine-2,6-dione Traditional Name: 7-benzyl-3-(4-chlorophenyl)-1-ethyl-4,5-dihydropurine-2,6-quinone Formula: C20H19ClN4O2 MolecularWeight: 382.84346

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2C(N=CN2CC3=CC=CC=C3)N(C1=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

CCN1C(=O)C2C(N=CN2CC3=CC=CC=C3)N(C1=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C20H19ClN4O2/c1-2-24-19(26)17-18(22-13-23(17)12-14-6-4-3-5-7-14)25(20(24)27)16-10-8-15(21)9-11-16/h3-11,13,17-18H,2,12H2,1H3