diethyl 2-methyl-5-[2-(6-phenylpyrimidin-4-yl)sulfanylpropanoylamino]furan-3,4-dicarboxylate

Systemtic Name: diethyl 2-methyl-5-[2-(6-phenylpyrimidin-4-yl)sulfanylpropanoylamino]furan-3,4-dicarboxylate Openeye Name: diethyl 2-methyl-5-[2-(6-phenylpyrimidin-4-yl)sulfanylpropanoylamino]furan-3,4-dicarboxylate CAS Name: 2-methyl-5-[[1-oxo-2-[(6-phenyl-4-pyrimidinyl)thio]propyl]amino]furan-3,4-dicarboxylic acid diethyl ester IUPAC Name: diethyl 2-methyl-5-[2-(6-phenylpyrimidin-4-yl)sulfanylpropanoylamino]furan-3,4-dicarboxylate Traditional Name: 2-methyl-5-[2-[(6-phenylpyrimidin-4-yl)thio]propanoylamino]furan-3,4-dicarboxylic acid diethyl ester Formula: C24H25N3O6S MolecularWeight: 483.5368

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC(=C1C(=O)OCC)NC(=O)C(C)SC2=NC=NC(=C2)C3=CC=CC=C3)C

Isomeric SMILES

CCOC(=O)C1=C(OC(=C1C(=O)OCC)NC(=O)C(C)SC2=NC=NC(=C2)C3=CC=CC=C3)C

InChI

InChI=1S/C24H25N3O6S/c1-5-31-23(29)19-14(3)33-22(20(19)24(30)32-6-2)27-21(28)15(4)34-18-12-17(25-13-26-18)16-10-8-7-9-11-16/h7-13,15H,5-6H2,1-4H3,(H,27,28)