6-(3,5-dimethylphenyl)sulfanyl-5-ethyl-1-prop-2-ynyl-pyrimidine-2,4-dione

Systemtic Name: 6-(3,5-dimethylphenyl)sulfanyl-5-ethyl-1-prop-2-ynyl-pyrimidine-2,4-dione Openeye Name: 6-(3,5-dimethylphenyl)sulfanyl-5-ethyl-1-prop-2-ynyl-pyrimidine-2,4-dione CAS Name: 6-[(3,5-dimethylphenyl)thio]-5-ethyl-1-prop-2-ynylpyrimidine-2,4-dione IUPAC Name: 6-(3,5-dimethylphenyl)sulfanyl-5-ethyl-1-prop-2-ynylpyrimidine-2,4-dione Traditional Name: 6-[(3,5-dimethylphenyl)thio]-5-ethyl-1-propargyl-pyrimidine-2,4-quinone Formula: C17H18N2O2S MolecularWeight: 314.40202

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(N(C(=O)NC1=O)CC#C)SC2=CC(=CC(=C2)C)C

Isomeric SMILES

CCC1=C(N(C(=O)NC1=O)CC#C)SC2=CC(=CC(=C2)C)C

InChI

InChI=1S/C17H18N2O2S/c1-5-7-19-16(14(6-2)15(20)18-17(19)21)22-13-9-11(3)8-12(4)10-13/h1,8-10H,6-7H2,2-4H3,(H,18,20,21)