ethyl 4-aminocarbonyl-2-methyl-5-[2-(6-methylpyrimidin-4-yl)sulfanylethanoylamino]furan-3-carboxylate

Systemtic Name: ethyl 4-aminocarbonyl-2-methyl-5-[2-(6-methylpyrimidin-4-yl)sulfanylethanoylamino]furan-3-carboxylate Openeye Name: ethyl 4-carbamoyl-2-methyl-5-[[2-(6-methylpyrimidin-4-yl)sulfanylacetyl]amino]furan-3-carboxylate CAS Name: 4-carbamoyl-2-methyl-5-[[2-[(6-methyl-4-pyrimidinyl)thio]-1-oxoethyl]amino]-3-furancarboxylic acid ethyl ester IUPAC Name: ethyl 4-carbamoyl-2-methyl-5-[[2-(6-methylpyrimidin-4-yl)sulfanylacetyl]amino]furan-3-carboxylate Traditional Name: 4-carbamoyl-2-methyl-5-[[2-[(6-methylpyrimidin-4-yl)thio]acetyl]amino]furan-3-carboxylic acid ethyl ester Formula: C16H18N4O5S MolecularWeight: 378.40292

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC(=C1C(=O)N)NC(=O)CSC2=NC=NC(=C2)C)C

Isomeric SMILES

CCOC(=O)C1=C(OC(=C1C(=O)N)NC(=O)CSC2=NC=NC(=C2)C)C

InChI

InChI=1S/C16H18N4O5S/c1-4-24-16(23)12-9(3)25-15(13(12)14(17)22)20-10(21)6-26-11-5-8(2)18-7-19-11/h5,7H,4,6H2,1-3H3,(H2,17,22)(H,20,21)