4-[[3-butyl-7-ethyl-2,6-bis(oxidanylidene)purin-8-yl]methylamino]-N-(4-methoxyphenyl)benzamide

Systemtic Name: 4-[[3-butyl-7-ethyl-2,6-bis(oxidanylidene)purin-8-yl]methylamino]-N-(4-methoxyphenyl)benzamide Openeye Name: 4-[(3-butyl-7-ethyl-2,6-dioxo-purin-8-yl)methylamino]-N-(4-methoxyphenyl)benzamide CAS Name: 4-[(3-butyl-7-ethyl-2,6-dioxo-8-purinyl)methylamino]-N-(4-methoxyphenyl)benzamide IUPAC Name: 4-[(3-butyl-7-ethyl-2,6-dioxopurin-8-yl)methylamino]-N-(4-methoxyphenyl)benzamide Traditional Name: 4-[(3-butyl-7-ethyl-2,6-diketo-purin-8-yl)methylamino]-N-(4-methoxyphenyl)benzamide Formula: C26H30N6O4 MolecularWeight: 490.5542

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C(=O)NC1=O)N(C(=N2)CNC3=CC=C(C=C3)C(=O)NC4=CC=C(C=C4)OC)CC

Isomeric SMILES

CCCCN1C2=C(C(=O)NC1=O)N(C(=N2)CNC3=CC=C(C=C3)C(=O)NC4=CC=C(C=C4)OC)CC

InChI

InChI=1S/C26H30N6O4/c1-4-6-15-32-23-22(25(34)30-26(32)35)31(5-2)21(29-23)16-27-18-9-7-17(8-10-18)24(33)28-19-11-13-20(36-3)14-12-19/h7-14,27H,4-6,15-16H2,1-3H3,(H,28,33)(H,30,34,35)