8-tert-butyl-1-(phenylmethyl)-3-propyl-purino[7,8-a]pyridine-2,4-dione

Systemtic Name: 8-tert-butyl-1-(phenylmethyl)-3-propyl-purino[7,8-a]pyridine-2,4-dione Openeye Name: 1-benzyl-8-tert-butyl-3-propyl-purino[7,8-a]pyridine-2,4-dione CAS Name: 8-tert-butyl-1-(phenylmethyl)-3-propylpurino[7,8-a]pyridine-2,4-dione IUPAC Name: 1-benzyl-8-tert-butyl-3-propylpurino[7,8-a]pyridine-2,4-dione Traditional Name: 1-benzyl-8-tert-butyl-3-propyl-purino[7,8-a]pyridine-2,4-quinone Formula: C23H26N4O2 MolecularWeight: 390.47814

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=C(N=C3N2C=CC(=C3)C(C)(C)C)N(C1=O)CC4=CC=CC=C4

Isomeric SMILES

CCCN1C(=O)C2=C(N=C3N2C=CC(=C3)C(C)(C)C)N(C1=O)CC4=CC=CC=C4

InChI

InChI=1S/C23H26N4O2/c1-5-12-26-21(28)19-20(27(22(26)29)15-16-9-7-6-8-10-16)24-18-14-17(23(2,3)4)11-13-25(18)19/h6-11,13-14H,5,12,15H2,1-4H3