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

Systemtic Name: 4-[[1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]methyl]-N-phenyl-benzamide Openeye Name: 4-[(1,3-dimethyl-2,6-dioxo-purin-7-yl)methyl]-N-phenyl-benzamide CAS Name: 4-[(1,3-dimethyl-2,6-dioxo-7-purinyl)methyl]-N-phenylbenzamide IUPAC Name: 4-[(1,3-dimethyl-2,6-dioxopurin-7-yl)methyl]-N-phenylbenzamide Traditional Name: 4-[(2,6-diketo-1,3-dimethyl-purin-7-yl)methyl]-N-phenyl-benzamide Formula: C21H19N5O3 MolecularWeight: 389.40726

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CC3=CC=C(C=C3)C(=O)NC4=CC=CC=C4

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CC3=CC=C(C=C3)C(=O)NC4=CC=CC=C4

InChI

InChI=1S/C21H19N5O3/c1-24-18-17(20(28)25(2)21(24)29)26(13-22-18)12-14-8-10-15(11-9-14)19(27)23-16-6-4-3-5-7-16/h3-11,13H,12H2,1-2H3,(H,23,27)