ethyl 4-[3-cyano-3-(4-methyl-1,3-thiazol-2-yl)-2-oxidanylidene-propyl]sulfanyl-2-(furan-2-yl)-6-methyl-pyrimidine-5-carboxylate

Systemtic Name: ethyl 4-[3-cyano-3-(4-methyl-1,3-thiazol-2-yl)-2-oxidanylidene-propyl]sulfanyl-2-(furan-2-yl)-6-methyl-pyrimidine-5-carboxylate Openeye Name: ethyl 4-[3-cyano-3-(4-methylthiazol-2-yl)-2-oxo-propyl]sulfanyl-2-(2-furyl)-6-methyl-pyrimidine-5-carboxylate CAS Name: 4-[[3-cyano-3-(4-methyl-2-thiazolyl)-2-oxopropyl]thio]-2-(2-furanyl)-6-methyl-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[3-cyano-3-(4-methyl-1,3-thiazol-2-yl)-2-oxopropyl]sulfanyl-2-(furan-2-yl)-6-methylpyrimidine-5-carboxylate Traditional Name: 4-[[3-cyano-2-keto-3-(4-methylthiazol-2-yl)propyl]thio]-2-(2-furyl)-6-methyl-pyrimidine-5-carboxylic acid ethyl ester Formula: C20H18N4O4S2 MolecularWeight: 442.51132

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(N=C1SCC(=O)C(C#N)C2=NC(=CS2)C)C3=CC=CO3)C

Isomeric SMILES

CCOC(=O)C1=C(N=C(N=C1SCC(=O)C(C#N)C2=NC(=CS2)C)C3=CC=CO3)C

InChI

InChI=1S/C20H18N4O4S2/c1-4-27-20(26)16-12(3)23-17(15-6-5-7-28-15)24-19(16)30-10-14(25)13(8-21)18-22-11(2)9-29-18/h5-7,9,13H,4,10H2,1-3H3