4-[1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]-N-phenyl-butanamide

Systemtic Name: 4-[1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]-N-phenyl-butanamide Openeye Name: 4-(1,3-dimethyl-2,6-dioxo-purin-7-yl)-N-phenyl-butanamide CAS Name: 4-(1,3-dimethyl-2,6-dioxo-7-purinyl)-N-phenylbutanamide IUPAC Name: 4-(1,3-dimethyl-2,6-dioxopurin-7-yl)-N-phenylbutanamide Traditional Name: 4-(2,6-diketo-1,3-dimethyl-purin-7-yl)-N-phenyl-butyramide Formula: C17H19N5O3 MolecularWeight: 341.36446

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CCCC(=O)NC3=CC=CC=C3

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CCCC(=O)NC3=CC=CC=C3

InChI

InChI=1S/C17H19N5O3/c1-20-15-14(16(24)21(2)17(20)25)22(11-18-15)10-6-9-13(23)19-12-7-4-3-5-8-12/h3-5,7-8,11H,6,9-10H2,1-2H3,(H,19,23)