ethyl 2-[2-chloranyl-4-(5-ethanoyl-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidin-4-yl)-6-ethoxy-phenoxy]ethanoate

Systemtic Name: ethyl 2-[2-chloranyl-4-(5-ethanoyl-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidin-4-yl)-6-ethoxy-phenoxy]ethanoate Openeye Name: ethyl 2-[4-(5-acetyl-6-methyl-2-thioxo-3,4-dihydro-1H-pyrimidin-4-yl)-2-chloro-6-ethoxy-phenoxy]acetate CAS Name: 2-[4-(5-acetyl-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidin-4-yl)-2-chloro-6-ethoxyphenoxy]acetic acid ethyl ester IUPAC Name: ethyl 2-[4-(5-acetyl-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidin-4-yl)-2-chloro-6-ethoxyphenoxy]acetate Traditional Name: 2-[4-(5-acetyl-6-methyl-2-thioxo-3,4-dihydro-1H-pyrimidin-4-yl)-2-chloro-6-ethoxy-phenoxy]acetic acid ethyl ester Formula: C19H23ClN2O5S MolecularWeight: 426.91432

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C2C(=C(NC(=S)N2)C)C(=O)C)Cl)OCC(=O)OCC

Isomeric SMILES

CCOC1=C(C(=CC(=C1)C2C(=C(NC(=S)N2)C)C(=O)C)Cl)OCC(=O)OCC

InChI

InChI=1S/C19H23ClN2O5S/c1-5-25-14-8-12(7-13(20)18(14)27-9-15(24)26-6-2)17-16(11(4)23)10(3)21-19(28)22-17/h7-8,17H,5-6,9H2,1-4H3,(H2,21,22,28)