3-[(3,5-dimethylphenyl)methyl]-1-prop-2-ynyl-pyrimidine-2,4-dione

Systemtic Name: 3-[(3,5-dimethylphenyl)methyl]-1-prop-2-ynyl-pyrimidine-2,4-dione Openeye Name: 3-[(3,5-dimethylphenyl)methyl]-1-prop-2-ynyl-pyrimidine-2,4-dione CAS Name: 3-[(3,5-dimethylphenyl)methyl]-1-prop-2-ynylpyrimidine-2,4-dione IUPAC Name: 3-[(3,5-dimethylphenyl)methyl]-1-prop-2-ynylpyrimidine-2,4-dione Traditional Name: 3-(3,5-dimethylbenzyl)-1-propargyl-pyrimidine-2,4-quinone Formula: C16H16N2O2 MolecularWeight: 268.31044

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)CN2C(=O)C=CN(C2=O)CC#C)C

Isomeric SMILES

CC1=CC(=CC(=C1)CN2C(=O)C=CN(C2=O)CC#C)C

InChI

InChI=1S/C16H16N2O2/c1-4-6-17-7-5-15(19)18(16(17)20)11-14-9-12(2)8-13(3)10-14/h1,5,7-10H,6,11H2,2-3H3