6-[(3,5-dimethylphenyl)methyl]-5-ethyl-1-(3-phenylprop-2-ynoxymethyl)pyrimidine-2,4-dione

Systemtic Name: 6-[(3,5-dimethylphenyl)methyl]-5-ethyl-1-(3-phenylprop-2-ynoxymethyl)pyrimidine-2,4-dione Openeye Name: 6-[(3,5-dimethylphenyl)methyl]-5-ethyl-1-(3-phenylprop-2-ynoxymethyl)pyrimidine-2,4-dione CAS Name: 6-[(3,5-dimethylphenyl)methyl]-5-ethyl-1-(3-phenylprop-2-ynoxymethyl)pyrimidine-2,4-dione IUPAC Name: 6-[(3,5-dimethylphenyl)methyl]-5-ethyl-1-(3-phenylprop-2-ynoxymethyl)pyrimidine-2,4-dione Traditional Name: 6-(3,5-dimethylbenzyl)-5-ethyl-1-(3-phenylprop-2-ynoxymethyl)pyrimidine-2,4-quinone Formula: C25H26N2O3 MolecularWeight: 402.48554

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(N(C(=O)NC1=O)COCC#CC2=CC=CC=C2)CC3=CC(=CC(=C3)C)C

Isomeric SMILES

CCC1=C(N(C(=O)NC1=O)COCC#CC2=CC=CC=C2)CC3=CC(=CC(=C3)C)C

InChI

InChI=1S/C25H26N2O3/c1-4-22-23(16-21-14-18(2)13-19(3)15-21)27(25(29)26-24(22)28)17-30-12-8-11-20-9-6-5-7-10-20/h5-7,9-10,13-15H,4,12,16-17H2,1-3H3,(H,26,28,29)