5-(4-methyl-2-methylsulfanyl-pyrimidin-5-yl)penta-2,4-diynyl 2-methylprop-2-enoate

Systemtic Name: 5-(4-methyl-2-methylsulfanyl-pyrimidin-5-yl)penta-2,4-diynyl 2-methylprop-2-enoate Openeye Name: 5-(4-methyl-2-methylsulfanyl-pyrimidin-5-yl)penta-2,4-diynyl 2-methylprop-2-enoate CAS Name: 2-methyl-2-propenoic acid 5-[4-methyl-2-(methylthio)-5-pyrimidinyl]penta-2,4-diynyl ester IUPAC Name: 5-(4-methyl-2-methylsulfanylpyrimidin-5-yl)penta-2,4-diynyl 2-methylprop-2-enoate Traditional Name: 2-methylacrylic acid 5-[4-methyl-2-(methylthio)pyrimidin-5-yl]penta-2,4-diynyl ester Formula: C15H14N2O2S MolecularWeight: 286.34886

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC=C1C#CC#CCOC(=O)C(=C)C)SC

Isomeric SMILES

CC1=NC(=NC=C1C#CC#CCOC(=O)C(=C)C)SC

InChI

InChI=1S/C15H14N2O2S/c1-11(2)14(18)19-9-7-5-6-8-13-10-16-15(20-4)17-12(13)3/h10H,1,9H2,2-4H3