2-[1,3-dimethyl-2,6-bis(oxidanylidene)purin-9-yl]-N-(1-phenylpropyl)ethanamide

Systemtic Name: 2-[1,3-dimethyl-2,6-bis(oxidanylidene)purin-9-yl]-N-(1-phenylpropyl)ethanamide Openeye Name: 2-(1,3-dimethyl-2,6-dioxo-purin-9-yl)-N-(1-phenylpropyl)acetamide CAS Name: 2-(1,3-dimethyl-2,6-dioxo-9-purinyl)-N-(1-phenylpropyl)acetamide IUPAC Name: 2-(1,3-dimethyl-2,6-dioxopurin-9-yl)-N-(1-phenylpropyl)acetamide Traditional Name: 2-(2,6-diketo-1,3-dimethyl-purin-9-yl)-N-(1-phenylpropyl)acetamide Formula: C18H21N5O3 MolecularWeight: 355.39104

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=CC=C1)NC(=O)CN2C=NC3=C2N(C(=O)N(C3=O)C)C

Isomeric SMILES

CCC(C1=CC=CC=C1)NC(=O)CN2C=NC3=C2N(C(=O)N(C3=O)C)C

InChI

InChI=1S/C18H21N5O3/c1-4-13(12-8-6-5-7-9-12)20-14(24)10-23-11-19-15-16(23)21(2)18(26)22(3)17(15)25/h5-9,11,13H,4,10H2,1-3H3,(H,20,24)