N-[(3,4-dimethoxyphenyl)methyl]-N-methyl-2-[6-[(phenylmethyl)amino]purin-9-yl]ethanamide

Systemtic Name: N-[(3,4-dimethoxyphenyl)methyl]-N-methyl-2-[6-[(phenylmethyl)amino]purin-9-yl]ethanamide Openeye Name: 2-[6-(benzylamino)purin-9-yl]-N-[(3,4-dimethoxyphenyl)methyl]-N-methyl-acetamide CAS Name: N-[(3,4-dimethoxyphenyl)methyl]-N-methyl-2-[6-[(phenylmethyl)amino]-9-purinyl]acetamide IUPAC Name: 2-[6-(benzylamino)purin-9-yl]-N-[(3,4-dimethoxyphenyl)methyl]-N-methylacetamide Traditional Name: 2-[6-(benzylamino)purin-9-yl]-N-methyl-N-veratryl-acetamide Formula: C24H26N6O3 MolecularWeight: 446.50164

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC(=C(C=C1)OC)OC)C(=O)CN2C=NC3=C2N=CN=C3NCC4=CC=CC=C4

Isomeric SMILES

CN(CC1=CC(=C(C=C1)OC)OC)C(=O)CN2C=NC3=C2N=CN=C3NCC4=CC=CC=C4

InChI

InChI=1S/C24H26N6O3/c1-29(13-18-9-10-19(32-2)20(11-18)33-3)21(31)14-30-16-28-22-23(26-15-27-24(22)30)25-12-17-7-5-4-6-8-17/h4-11,15-16H,12-14H2,1-3H3,(H,25,26,27)