8-[6-(2-methoxyethyl)pyridin-3-yl]-3-methyl-1-prop-2-ynyl-5,7-dihydro-4H-purine-2,6-dione

Systemtic Name: 8-[6-(2-methoxyethyl)pyridin-3-yl]-3-methyl-1-prop-2-ynyl-5,7-dihydro-4H-purine-2,6-dione Openeye Name: 8-[6-(2-methoxyethyl)-3-pyridyl]-3-methyl-1-prop-2-ynyl-5,7-dihydro-4H-purine-2,6-dione CAS Name: 8-[6-(2-methoxyethyl)-3-pyridinyl]-3-methyl-1-prop-2-ynyl-5,7-dihydro-4H-purine-2,6-dione IUPAC Name: 8-[6-(2-methoxyethyl)pyridin-3-yl]-3-methyl-1-prop-2-ynyl-5,7-dihydro-4H-purine-2,6-dione Traditional Name: 8-[6-(2-methoxyethyl)-3-pyridyl]-3-methyl-1-propargyl-5,7-dihydro-4H-purine-2,6-quinone Formula: C17H19N5O3 MolecularWeight: 341.36446

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2C(C(=O)N(C1=O)CC#C)NC(=N2)C3=CN=C(C=C3)CCOC

Isomeric SMILES

CN1C2C(C(=O)N(C1=O)CC#C)NC(=N2)C3=CN=C(C=C3)CCOC

InChI

InChI=1S/C17H19N5O3/c1-4-8-22-16(23)13-15(21(2)17(22)24)20-14(19-13)11-5-6-12(18-10-11)7-9-25-3/h1,5-6,10,13,15H,7-9H2,2-3H3,(H,19,20)