N-cyclopropyl-3-[6-[ethyl(propan-2-yl)amino]purin-9-yl]-4-methyl-benzamide

Systemtic Name: N-cyclopropyl-3-[6-[ethyl(propan-2-yl)amino]purin-9-yl]-4-methyl-benzamide Openeye Name: N-cyclopropyl-3-[6-[ethyl(isopropyl)amino]purin-9-yl]-4-methyl-benzamide CAS Name: N-cyclopropyl-3-[6-[ethyl(propan-2-yl)amino]-9-purinyl]-4-methylbenzamide IUPAC Name: N-cyclopropyl-3-[6-[ethyl(propan-2-yl)amino]purin-9-yl]-4-methylbenzamide Traditional Name: N-cyclopropyl-3-[6-[ethyl(isopropyl)amino]purin-9-yl]-4-methyl-benzamide Formula: C21H26N6O MolecularWeight: 378.47074

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=NC=NC2=C1N=CN2C3=C(C=CC(=C3)C(=O)NC4CC4)C)C(C)C

Isomeric SMILES

CCN(C1=NC=NC2=C1N=CN2C3=C(C=CC(=C3)C(=O)NC4CC4)C)C(C)C

InChI

InChI=1S/C21H26N6O/c1-5-26(13(2)3)19-18-20(23-11-22-19)27(12-24-18)17-10-15(7-6-14(17)4)21(28)25-16-8-9-16/h6-7,10-13,16H,5,8-9H2,1-4H3,(H,25,28)