1,3-dipropyl-8-[6-(2-pyridin-2-ylethylamino)pyridin-3-yl]-5,7-dihydro-4H-purine-2,6-dione

Systemtic Name: 1,3-dipropyl-8-[6-(2-pyridin-2-ylethylamino)pyridin-3-yl]-5,7-dihydro-4H-purine-2,6-dione Openeye Name: 1,3-dipropyl-8-[6-[2-(2-pyridyl)ethylamino]-3-pyridyl]-5,7-dihydro-4H-purine-2,6-dione CAS Name: 1,3-dipropyl-8-[6-[2-(2-pyridinyl)ethylamino]-3-pyridinyl]-5,7-dihydro-4H-purine-2,6-dione IUPAC Name: 1,3-dipropyl-8-[6-(2-pyridin-2-ylethylamino)pyridin-3-yl]-5,7-dihydro-4H-purine-2,6-dione Traditional Name: 1,3-dipropyl-8-[6-[2-(2-pyridyl)ethylamino]-3-pyridyl]-5,7-dihydro-4H-purine-2,6-quinone Formula: C23H29N7O2 MolecularWeight: 435.52206

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2C(C(=O)N(C1=O)CCC)NC(=N2)C3=CN=C(C=C3)NCCC4=CC=CC=N4

Isomeric SMILES

CCCN1C2C(C(=O)N(C1=O)CCC)NC(=N2)C3=CN=C(C=C3)NCCC4=CC=CC=N4

InChI

InChI=1S/C23H29N7O2/c1-3-13-29-21-19(22(31)30(14-4-2)23(29)32)27-20(28-21)16-8-9-18(26-15-16)25-12-10-17-7-5-6-11-24-17/h5-9,11,15,19,21H,3-4,10,12-14H2,1-2H3,(H,25,26)(H,27,28)