8-(6-ethylpyridin-3-yl)-1,3-dipropyl-5,7-dihydro-4H-purine-2,6-dione

Systemtic Name: 8-(6-ethylpyridin-3-yl)-1,3-dipropyl-5,7-dihydro-4H-purine-2,6-dione Openeye Name: 8-(6-ethyl-3-pyridyl)-1,3-dipropyl-5,7-dihydro-4H-purine-2,6-dione CAS Name: 8-(6-ethyl-3-pyridinyl)-1,3-dipropyl-5,7-dihydro-4H-purine-2,6-dione IUPAC Name: 8-(6-ethylpyridin-3-yl)-1,3-dipropyl-5,7-dihydro-4H-purine-2,6-dione Traditional Name: 8-(6-ethyl-3-pyridyl)-1,3-dipropyl-5,7-dihydro-4H-purine-2,6-quinone Formula: C18H25N5O2 MolecularWeight: 343.4234

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H25N5O2/c1-4-9-22-16-14(17(24)23(10-5-2)18(22)25)20-15(21-16)12-7-8-13(6-3)19-11-12/h7-8,11,14,16H,4-6,9-10H2,1-3H3,(H,20,21)