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

Systemtic Name: 3-[1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]-N-(2-ethyl-6-methyl-phenyl)propanamide Openeye Name: 3-(1,3-dimethyl-2,6-dioxo-purin-7-yl)-N-(2-ethyl-6-methyl-phenyl)propanamide CAS Name: 3-(1,3-dimethyl-2,6-dioxo-7-purinyl)-N-(2-ethyl-6-methylphenyl)propanamide IUPAC Name: 3-(1,3-dimethyl-2,6-dioxopurin-7-yl)-N-(2-ethyl-6-methylphenyl)propanamide Traditional Name: 3-(2,6-diketo-1,3-dimethyl-purin-7-yl)-N-(2-ethyl-6-methyl-phenyl)propionamide Formula: C19H23N5O3 MolecularWeight: 369.41762

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1NC(=O)CCN2C=NC3=C2C(=O)N(C(=O)N3C)C)C

Isomeric SMILES

CCC1=CC=CC(=C1NC(=O)CCN2C=NC3=C2C(=O)N(C(=O)N3C)C)C

InChI

InChI=1S/C19H23N5O3/c1-5-13-8-6-7-12(2)15(13)21-14(25)9-10-24-11-20-17-16(24)18(26)23(4)19(27)22(17)3/h6-8,11H,5,9-10H2,1-4H3,(H,21,25)