2-[1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]-N-[(4-methylphenyl)methyl]propanamide

Systemtic Name: 2-[1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]-N-[(4-methylphenyl)methyl]propanamide Openeye Name: 2-(1,3-dimethyl-2,6-dioxo-purin-7-yl)-N-(p-tolylmethyl)propanamide CAS Name: 2-(1,3-dimethyl-2,6-dioxo-7-purinyl)-N-[(4-methylphenyl)methyl]propanamide IUPAC Name: 2-(1,3-dimethyl-2,6-dioxopurin-7-yl)-N-[(4-methylphenyl)methyl]propanamide Traditional Name: 2-(2,6-diketo-1,3-dimethyl-purin-7-yl)-N-(4-methylbenzyl)propionamide Formula: C18H21N5O3 MolecularWeight: 355.39104

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC(=O)C(C)N2C=NC3=C2C(=O)N(C(=O)N3C)C

Isomeric SMILES

CC1=CC=C(C=C1)CNC(=O)C(C)N2C=NC3=C2C(=O)N(C(=O)N3C)C

InChI

InChI=1S/C18H21N5O3/c1-11-5-7-13(8-6-11)9-19-16(24)12(2)23-10-20-15-14(23)17(25)22(4)18(26)21(15)3/h5-8,10,12H,9H2,1-4H3,(H,19,24)