8-[6-(methylamino)pyridin-3-yl]-1,3-bis(prop-2-enyl)-5,7-dihydro-4H-purine-2,6-dione

Systemtic Name: 8-[6-(methylamino)pyridin-3-yl]-1,3-bis(prop-2-enyl)-5,7-dihydro-4H-purine-2,6-dione Openeye Name: 1,3-diallyl-8-[6-(methylamino)-3-pyridyl]-5,7-dihydro-4H-purine-2,6-dione CAS Name: 8-[6-(methylamino)-3-pyridinyl]-1,3-bis(prop-2-enyl)-5,7-dihydro-4H-purine-2,6-dione IUPAC Name: 8-[6-(methylamino)pyridin-3-yl]-1,3-bis(prop-2-enyl)-5,7-dihydro-4H-purine-2,6-dione Traditional Name: 1,3-diallyl-8-[6-(methylamino)-3-pyridyl]-5,7-dihydro-4H-purine-2,6-quinone Formula: C17H20N6O2 MolecularWeight: 340.3797

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=NC=C(C=C1)C2=NC3C(N2)C(=O)N(C(=O)N3CC=C)CC=C

Isomeric SMILES

CNC1=NC=C(C=C1)C2=NC3C(N2)C(=O)N(C(=O)N3CC=C)CC=C

InChI

InChI=1S/C17H20N6O2/c1-4-8-22-15-13(16(24)23(9-5-2)17(22)25)20-14(21-15)11-6-7-12(18-3)19-10-11/h4-7,10,13,15H,1-2,8-9H2,3H3,(H,18,19)(H,20,21)