1-butyl-5-(2-methoxyethyl)-7-phenethyl-pteridine-2,4,6-trione

Systemtic Name: 1-butyl-5-(2-methoxyethyl)-7-phenethyl-pteridine-2,4,6-trione Openeye Name: 1-butyl-5-(2-methoxyethyl)-7-phenethyl-pteridine-2,4,6-trione CAS Name: 1-butyl-5-(2-methoxyethyl)-7-phenethylpteridine-2,4,6-trione IUPAC Name: 1-butyl-5-(2-methoxyethyl)-7-phenethylpteridine-2,4,6-trione Traditional Name: 1-butyl-5-(2-methoxyethyl)-7-phenethyl-pteridine-2,4,6-trione Formula: C21H26N4O4 MolecularWeight: 398.45554

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C(=O)NC1=O)N(C(=O)C(=N2)CCC3=CC=CC=C3)CCOC

Isomeric SMILES

CCCCN1C2=C(C(=O)NC1=O)N(C(=O)C(=N2)CCC3=CC=CC=C3)CCOC

InChI

InChI=1S/C21H26N4O4/c1-3-4-12-25-18-17(19(26)23-21(25)28)24(13-14-29-2)20(27)16(22-18)11-10-15-8-6-5-7-9-15/h5-9H,3-4,10-14H2,1-2H3,(H,23,26,28)