3-(6-cyclopentylpurin-9-yl)-N-cyclopropyl-4-methyl-benzamide

Systemtic Name: 3-(6-cyclopentylpurin-9-yl)-N-cyclopropyl-4-methyl-benzamide Openeye Name: 3-(6-cyclopentylpurin-9-yl)-N-cyclopropyl-4-methyl-benzamide CAS Name: 3-(6-cyclopentyl-9-purinyl)-N-cyclopropyl-4-methylbenzamide IUPAC Name: 3-(6-cyclopentylpurin-9-yl)-N-cyclopropyl-4-methylbenzamide Traditional Name: 3-(6-cyclopentylpurin-9-yl)-N-cyclopropyl-4-methyl-benzamide Formula: C21H23N5O MolecularWeight: 361.44022

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC2CC2)N3C=NC4=C(N=CN=C43)C5CCCC5

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC2CC2)N3C=NC4=C(N=CN=C43)C5CCCC5

InChI

InChI=1S/C21H23N5O/c1-13-6-7-15(21(27)25-16-8-9-16)10-17(13)26-12-24-19-18(14-4-2-3-5-14)22-11-23-20(19)26/h6-7,10-12,14,16H,2-5,8-9H2,1H3,(H,25,27)