N-cyclopropyl-4-methyl-3-(2-oxidanylidene-6-phenyl-1H-purin-9-yl)benzamide

Systemtic Name: N-cyclopropyl-4-methyl-3-(2-oxidanylidene-6-phenyl-1H-purin-9-yl)benzamide Openeye Name: N-cyclopropyl-4-methyl-3-(2-oxo-6-phenyl-1H-purin-9-yl)benzamide CAS Name: N-cyclopropyl-4-methyl-3-(2-oxo-6-phenyl-1H-purin-9-yl)benzamide IUPAC Name: N-cyclopropyl-4-methyl-3-(2-oxo-6-phenyl-1H-purin-9-yl)benzamide Traditional Name: N-cyclopropyl-3-(2-keto-6-phenyl-1H-purin-9-yl)-4-methyl-benzamide Formula: C22H19N5O2 MolecularWeight: 385.41856

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC2CC2)N3C=NC4=C(NC(=O)N=C43)C5=CC=CC=C5

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC2CC2)N3C=NC4=C(NC(=O)N=C43)C5=CC=CC=C5

InChI

InChI=1S/C22H19N5O2/c1-13-7-8-15(21(28)24-16-9-10-16)11-17(13)27-12-23-19-18(14-5-3-2-4-6-14)25-22(29)26-20(19)27/h2-8,11-12,16H,9-10H2,1H3,(H,24,28)(H,25,26,29)