3-[1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]-N-phenethyl-N-(phenylmethyl)propanamide

Systemtic Name: 3-[1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]-N-phenethyl-N-(phenylmethyl)propanamide Openeye Name: N-benzyl-3-(1,3-dimethyl-2,6-dioxo-purin-7-yl)-N-phenethyl-propanamide CAS Name: 3-(1,3-dimethyl-2,6-dioxo-7-purinyl)-N-phenethyl-N-(phenylmethyl)propanamide IUPAC Name: N-benzyl-3-(1,3-dimethyl-2,6-dioxopurin-7-yl)-N-phenethylpropanamide Traditional Name: N-benzyl-3-(2,6-diketo-1,3-dimethyl-purin-7-yl)-N-phenethyl-propionamide Formula: C25H27N5O3 MolecularWeight: 445.51358

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CCC(=O)N(CCC3=CC=CC=C3)CC4=CC=CC=C4

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CCC(=O)N(CCC3=CC=CC=C3)CC4=CC=CC=C4

InChI

InChI=1S/C25H27N5O3/c1-27-23-22(24(32)28(2)25(27)33)30(18-26-23)16-14-21(31)29(17-20-11-7-4-8-12-20)15-13-19-9-5-3-6-10-19/h3-12,18H,13-17H2,1-2H3