[3-butyl-2,6-bis(oxidanylidene)-7-propyl-purin-8-yl]methyl 2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)ethanoate

Systemtic Name: [3-butyl-2,6-bis(oxidanylidene)-7-propyl-purin-8-yl]methyl 2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)ethanoate Openeye Name: (3-butyl-2,6-dioxo-7-propyl-purin-8-yl)methyl 2-(5-methyl-2-phenyl-oxazol-4-yl)acetate CAS Name: 2-(5-methyl-2-phenyl-4-oxazolyl)acetic acid (3-butyl-2,6-dioxo-7-propyl-8-purinyl)methyl ester IUPAC Name: (3-butyl-2,6-dioxo-7-propylpurin-8-yl)methyl 2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)acetate Traditional Name: 2-(5-methyl-2-phenyl-oxazol-4-yl)acetic acid (3-butyl-2,6-diketo-7-propyl-purin-8-yl)methyl ester Formula: C25H29N5O5 MolecularWeight: 479.52826

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C(=O)NC1=O)N(C(=N2)COC(=O)CC3=C(OC(=N3)C4=CC=CC=C4)C)CCC

Isomeric SMILES

CCCCN1C2=C(C(=O)NC1=O)N(C(=N2)COC(=O)CC3=C(OC(=N3)C4=CC=CC=C4)C)CCC

InChI

InChI=1S/C25H29N5O5/c1-4-6-13-30-22-21(23(32)28-25(30)33)29(12-5-2)19(27-22)15-34-20(31)14-18-16(3)35-24(26-18)17-10-8-7-9-11-17/h7-11H,4-6,12-15H2,1-3H3,(H,28,32,33)