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

Systemtic Name: 4-[1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]-N-(1,4-diphenylbutyl)butanamide Openeye Name: 4-(1,3-dimethyl-2,6-dioxo-purin-7-yl)-N-(1,4-diphenylbutyl)butanamide CAS Name: 4-(1,3-dimethyl-2,6-dioxo-7-purinyl)-N-(1,4-diphenylbutyl)butanamide IUPAC Name: 4-(1,3-dimethyl-2,6-dioxopurin-7-yl)-N-(1,4-diphenylbutyl)butanamide Traditional Name: 4-(2,6-diketo-1,3-dimethyl-purin-7-yl)-N-(1,4-diphenylbutyl)butyramide Formula: C27H31N5O3 MolecularWeight: 473.56674

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CCCC(=O)NC(CCCC3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CCCC(=O)NC(CCCC3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C27H31N5O3/c1-30-25-24(26(34)31(2)27(30)35)32(19-28-25)18-10-17-23(33)29-22(21-14-7-4-8-15-21)16-9-13-20-11-5-3-6-12-20/h3-8,11-12,14-15,19,22H,9-10,13,16-18H2,1-2H3,(H,29,33)