4-[1,3-dimethyl-2,6-bis(oxidanylidene)-7H-purin-8-yl]-N-(3-pyridin-4-ylpropyl)butanamide

Systemtic Name: 4-[1,3-dimethyl-2,6-bis(oxidanylidene)-7H-purin-8-yl]-N-(3-pyridin-4-ylpropyl)butanamide Openeye Name: 4-(1,3-dimethyl-2,6-dioxo-7H-purin-8-yl)-N-[3-(4-pyridyl)propyl]butanamide CAS Name: 4-(1,3-dimethyl-2,6-dioxo-7H-purin-8-yl)-N-(3-pyridin-4-ylpropyl)butanamide IUPAC Name: 4-(1,3-dimethyl-2,6-dioxo-7H-purin-8-yl)-N-(3-pyridin-4-ylpropyl)butanamide Traditional Name: 4-(2,6-diketo-1,3-dimethyl-7H-purin-8-yl)-N-[3-(4-pyridyl)propyl]butyramide Formula: C19H24N6O3 MolecularWeight: 384.43226

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)NC(=N2)CCCC(=O)NCCCC3=CC=NC=C3

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)NC(=N2)CCCC(=O)NCCCC3=CC=NC=C3

InChI

InChI=1S/C19H24N6O3/c1-24-17-16(18(27)25(2)19(24)28)22-14(23-17)6-3-7-15(26)21-10-4-5-13-8-11-20-12-9-13/h8-9,11-12H,3-7,10H2,1-2H3,(H,21,26)(H,22,23)