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

Systemtic Name: ethyl (4S)-6-[[(2E,4E)-hexa-2,4-dienoyl]oxymethyl]-2-oxidanylidene-4-thiophen-2-yl-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl (4S)-6-[[(2E,4E)-hexa-2,4-dienoyl]oxymethyl]-2-oxo-4-(2-thienyl)-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: (4S)-2-oxo-6-[[(2E,4E)-1-oxohexa-2,4-dienoxy]methyl]-4-thiophen-2-yl-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl (4S)-6-[[(2E,4E)-hexa-2,4-dienoyl]oxymethyl]-2-oxo-4-thiophen-2-yl-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: (4S)-6-[[(2E,4E)-hexa-2,4-dienoyl]oxymethyl]-2-keto-4-(2-thienyl)-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C18H20N2O5S MolecularWeight: 376.4268

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=O)NC1C2=CC=CS2)COC(=O)C=CC=CC

Isomeric SMILES

CCOC(=O)C1=C(NC(=O)N[C@@H]1C2=CC=CS2)COC(=O)/C=C/C=C/C

InChI

InChI=1S/C18H20N2O5S/c1-3-5-6-9-14(21)25-11-12-15(17(22)24-4-2)16(20-18(23)19-12)13-8-7-10-26-13/h3,5-10,16H,4,11H2,1-2H3,(H2,19,20,23)/b5-3+,9-6+/t16-/m1/s1