ethyl 2-[2-(furan-2-ylmethylamino)-2-oxidanylidene-ethyl]sulfanyl-6-oxidanylidene-1-phenyl-pyrimidine-5-carboxylate

Systemtic Name: ethyl 2-[2-(furan-2-ylmethylamino)-2-oxidanylidene-ethyl]sulfanyl-6-oxidanylidene-1-phenyl-pyrimidine-5-carboxylate Openeye Name: ethyl 2-[2-(2-furylmethylamino)-2-oxo-ethyl]sulfanyl-6-oxo-1-phenyl-pyrimidine-5-carboxylate CAS Name: 2-[[2-(2-furanylmethylamino)-2-oxoethyl]thio]-6-oxo-1-phenyl-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[2-(furan-2-ylmethylamino)-2-oxoethyl]sulfanyl-6-oxo-1-phenylpyrimidine-5-carboxylate Traditional Name: 2-[[2-(2-furfurylamino)-2-keto-ethyl]thio]-6-keto-1-phenyl-pyrimidine-5-carboxylic acid ethyl ester Formula: C20H19N3O5S MolecularWeight: 413.44696

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C(N(C1=O)C2=CC=CC=C2)SCC(=O)NCC3=CC=CO3

Isomeric SMILES

CCOC(=O)C1=CN=C(N(C1=O)C2=CC=CC=C2)SCC(=O)NCC3=CC=CO3

InChI

InChI=1S/C20H19N3O5S/c1-2-27-19(26)16-12-22-20(23(18(16)25)14-7-4-3-5-8-14)29-13-17(24)21-11-15-9-6-10-28-15/h3-10,12H,2,11,13H2,1H3,(H,21,24)