ethyl 4-aminocarbonyl-2-methyl-5-[3-(2-methyl-6-phenyl-pyrimidin-4-yl)sulfanylpropanoylamino]furan-3-carboxylate

Systemtic Name: ethyl 4-aminocarbonyl-2-methyl-5-[3-(2-methyl-6-phenyl-pyrimidin-4-yl)sulfanylpropanoylamino]furan-3-carboxylate Openeye Name: ethyl 4-carbamoyl-2-methyl-5-[3-(2-methyl-6-phenyl-pyrimidin-4-yl)sulfanylpropanoylamino]furan-3-carboxylate CAS Name: 4-carbamoyl-2-methyl-5-[[3-[(2-methyl-6-phenyl-4-pyrimidinyl)thio]-1-oxopropyl]amino]-3-furancarboxylic acid ethyl ester IUPAC Name: ethyl 4-carbamoyl-2-methyl-5-[3-(2-methyl-6-phenylpyrimidin-4-yl)sulfanylpropanoylamino]furan-3-carboxylate Traditional Name: 4-carbamoyl-2-methyl-5-[3-[(2-methyl-6-phenyl-pyrimidin-4-yl)thio]propanoylamino]furan-3-carboxylic acid ethyl ester Formula: C23H24N4O5S MolecularWeight: 468.52546

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC(=C1C(=O)N)NC(=O)CCSC2=NC(=NC(=C2)C3=CC=CC=C3)C)C

Isomeric SMILES

CCOC(=O)C1=C(OC(=C1C(=O)N)NC(=O)CCSC2=NC(=NC(=C2)C3=CC=CC=C3)C)C

InChI

InChI=1S/C23H24N4O5S/c1-4-31-23(30)19-13(2)32-22(20(19)21(24)29)27-17(28)10-11-33-18-12-16(25-14(3)26-18)15-8-6-5-7-9-15/h5-9,12H,4,10-11H2,1-3H3,(H2,24,29)(H,27,28)