1-(ethoxymethyl)-5-methyl-6-[[3-(2-pyridin-3-ylethynyl)phenyl]methyl]pyrimidine-2,4-dione

Systemtic Name: 1-(ethoxymethyl)-5-methyl-6-[[3-(2-pyridin-3-ylethynyl)phenyl]methyl]pyrimidine-2,4-dione Openeye Name: 1-(ethoxymethyl)-5-methyl-6-[[3-[2-(3-pyridyl)ethynyl]phenyl]methyl]pyrimidine-2,4-dione CAS Name: 1-(ethoxymethyl)-5-methyl-6-[[3-[2-(3-pyridinyl)ethynyl]phenyl]methyl]pyrimidine-2,4-dione IUPAC Name: 1-(ethoxymethyl)-5-methyl-6-[[3-(2-pyridin-3-ylethynyl)phenyl]methyl]pyrimidine-2,4-dione Traditional Name: 1-(ethoxymethyl)-5-methyl-6-[3-[2-(3-pyridyl)ethynyl]benzyl]pyrimidine-2,4-quinone Formula: C22H21N3O3 MolecularWeight: 375.42044

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Descriptors Computed from Structure

Canonical SMILES:

CCOCN1C(=C(C(=O)NC1=O)C)CC2=CC=CC(=C2)C#CC3=CN=CC=C3

Isomeric SMILES

CCOCN1C(=C(C(=O)NC1=O)C)CC2=CC=CC(=C2)C#CC3=CN=CC=C3

InChI

InChI=1S/C22H21N3O3/c1-3-28-15-25-20(16(2)21(26)24-22(25)27)13-19-7-4-6-17(12-19)9-10-18-8-5-11-23-14-18/h4-8,11-12,14H,3,13,15H2,1-2H3,(H,24,26,27)