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

Systemtic Name: 4-[1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]-N-methyl-N-[(4-phenylphenyl)methyl]butanamide Openeye Name: 4-(1,3-dimethyl-2,6-dioxo-purin-7-yl)-N-methyl-N-[(4-phenylphenyl)methyl]butanamide CAS Name: 4-(1,3-dimethyl-2,6-dioxo-7-purinyl)-N-methyl-N-[(4-phenylphenyl)methyl]butanamide IUPAC Name: 4-(1,3-dimethyl-2,6-dioxopurin-7-yl)-N-methyl-N-[(4-phenylphenyl)methyl]butanamide Traditional Name: 4-(2,6-diketo-1,3-dimethyl-purin-7-yl)-N-methyl-N-(4-phenylbenzyl)butyramide Formula: C25H27N5O3 MolecularWeight: 445.51358

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CCCC(=O)N(C)CC3=CC=C(C=C3)C4=CC=CC=C4

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CCCC(=O)N(C)CC3=CC=C(C=C3)C4=CC=CC=C4

InChI

InChI=1S/C25H27N5O3/c1-27(16-18-11-13-20(14-12-18)19-8-5-4-6-9-19)21(31)10-7-15-30-17-26-23-22(30)24(32)29(3)25(33)28(23)2/h4-6,8-9,11-14,17H,7,10,15-16H2,1-3H3