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

Systemtic Name: ethyl 4-aminocarbonyl-2-methyl-5-[3-(6-methylpyrimidin-4-yl)sulfanylpropanoylamino]furan-3-carboxylate Openeye Name: ethyl 4-carbamoyl-2-methyl-5-[3-(6-methylpyrimidin-4-yl)sulfanylpropanoylamino]furan-3-carboxylate CAS Name: 4-carbamoyl-2-methyl-5-[[3-[(6-methyl-4-pyrimidinyl)thio]-1-oxopropyl]amino]-3-furancarboxylic acid ethyl ester IUPAC Name: ethyl 4-carbamoyl-2-methyl-5-[3-(6-methylpyrimidin-4-yl)sulfanylpropanoylamino]furan-3-carboxylate Traditional Name: 4-carbamoyl-2-methyl-5-[3-[(6-methylpyrimidin-4-yl)thio]propanoylamino]furan-3-carboxylic acid ethyl ester Formula: C17H20N4O5S MolecularWeight: 392.4295

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H20N4O5S/c1-4-25-17(24)13-10(3)26-16(14(13)15(18)23)21-11(22)5-6-27-12-7-9(2)19-8-20-12/h7-8H,4-6H2,1-3H3,(H2,18,23)(H,21,22)