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

Systemtic Name: 1,3-diethyl-8-[6-(2-pyrrolidin-1-ylethylamino)pyridin-3-yl]-5,7-dihydro-4H-purine-2,6-dione Openeye Name: 1,3-diethyl-8-[6-(2-pyrrolidin-1-ylethylamino)-3-pyridyl]-5,7-dihydro-4H-purine-2,6-dione CAS Name: 1,3-diethyl-8-[6-[2-(1-pyrrolidinyl)ethylamino]-3-pyridinyl]-5,7-dihydro-4H-purine-2,6-dione IUPAC Name: 1,3-diethyl-8-[6-(2-pyrrolidin-1-ylethylamino)pyridin-3-yl]-5,7-dihydro-4H-purine-2,6-dione Traditional Name: 1,3-diethyl-8-[6-(2-pyrrolidinoethylamino)-3-pyridyl]-5,7-dihydro-4H-purine-2,6-quinone Formula: C20H29N7O2 MolecularWeight: 399.48996

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2C(C(=O)N(C1=O)CC)NC(=N2)C3=CN=C(C=C3)NCCN4CCCC4

Isomeric SMILES

CCN1C2C(C(=O)N(C1=O)CC)NC(=N2)C3=CN=C(C=C3)NCCN4CCCC4

InChI

InChI=1S/C20H29N7O2/c1-3-26-18-16(19(28)27(4-2)20(26)29)23-17(24-18)14-7-8-15(22-13-14)21-9-12-25-10-5-6-11-25/h7-8,13,16,18H,3-6,9-12H2,1-2H3,(H,21,22)(H,23,24)