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

Systemtic Name: diethyl 2-methyl-5-[3-(6-methylpyrimidin-4-yl)sulfanylpropanoylamino]furan-3,4-dicarboxylate Openeye Name: diethyl 2-methyl-5-[3-(6-methylpyrimidin-4-yl)sulfanylpropanoylamino]furan-3,4-dicarboxylate CAS Name: 2-methyl-5-[[3-[(6-methyl-4-pyrimidinyl)thio]-1-oxopropyl]amino]furan-3,4-dicarboxylic acid diethyl ester IUPAC Name: diethyl 2-methyl-5-[3-(6-methylpyrimidin-4-yl)sulfanylpropanoylamino]furan-3,4-dicarboxylate Traditional Name: 2-methyl-5-[3-[(6-methylpyrimidin-4-yl)thio]propanoylamino]furan-3,4-dicarboxylic acid diethyl ester Formula: C19H23N3O6S MolecularWeight: 421.46742

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC(=C1C(=O)OCC)NC(=O)CCSC2=NC=NC(=C2)C)C

Isomeric SMILES

CCOC(=O)C1=C(OC(=C1C(=O)OCC)NC(=O)CCSC2=NC=NC(=C2)C)C

InChI

InChI=1S/C19H23N3O6S/c1-5-26-18(24)15-12(4)28-17(16(15)19(25)27-6-2)22-13(23)7-8-29-14-9-11(3)20-10-21-14/h9-10H,5-8H2,1-4H3,(H,22,23)