ethyl (4S)-4-(furan-2-yl)-1,6-dimethyl-2-methylsulfanyl-4H-pyrimidine-5-carboxylate

Systemtic Name: ethyl (4S)-4-(furan-2-yl)-1,6-dimethyl-2-methylsulfanyl-4H-pyrimidine-5-carboxylate Openeye Name: ethyl (4S)-4-(2-furyl)-1,6-dimethyl-2-methylsulfanyl-4H-pyrimidine-5-carboxylate CAS Name: (4S)-4-(2-furanyl)-1,6-dimethyl-2-(methylthio)-4H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl (4S)-4-(furan-2-yl)-1,6-dimethyl-2-methylsulfanyl-4H-pyrimidine-5-carboxylate Traditional Name: (4S)-4-(2-furyl)-1,6-dimethyl-2-(methylthio)-4H-pyrimidine-5-carboxylic acid ethyl ester Formula: C14H18N2O3S MolecularWeight: 294.36932

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=NC1C2=CC=CO2)SC)C)C

Isomeric SMILES

CCOC(=O)C1=C(N(C(=N[C@@H]1C2=CC=CO2)SC)C)C

InChI

InChI=1S/C14H18N2O3S/c1-5-18-13(17)11-9(2)16(3)14(20-4)15-12(11)10-7-6-8-19-10/h6-8,12H,5H2,1-4H3/t12-/m1/s1