ethyl (4S)-4-ethyl-2-oxidanylidene-6-[[(E)-3-thiophen-2-ylprop-2-enoyl]oxymethyl]-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: ethyl (4S)-4-ethyl-2-oxidanylidene-6-[[(E)-3-thiophen-2-ylprop-2-enoyl]oxymethyl]-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl (4S)-4-ethyl-2-oxo-6-[[(E)-3-(2-thienyl)prop-2-enoyl]oxymethyl]-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: (4S)-4-ethyl-2-oxo-6-[[(E)-1-oxo-3-thiophen-2-ylprop-2-enoxy]methyl]-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl (4S)-4-ethyl-2-oxo-6-[[(E)-3-thiophen-2-ylprop-2-enoyl]oxymethyl]-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: (4S)-4-ethyl-2-keto-6-[[(E)-3-(2-thienyl)acryloyl]oxymethyl]-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C17H20N2O5S MolecularWeight: 364.4161

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C(=C(NC(=O)N1)COC(=O)C=CC2=CC=CS2)C(=O)OCC

Isomeric SMILES

CC[C@H]1C(=C(NC(=O)N1)COC(=O)/C=C/C2=CC=CS2)C(=O)OCC

InChI

InChI=1S/C17H20N2O5S/c1-3-12-15(16(21)23-4-2)13(19-17(22)18-12)10-24-14(20)8-7-11-6-5-9-25-11/h5-9,12H,3-4,10H2,1-2H3,(H2,18,19,22)/b8-7+/t12-/m0/s1