ethyl (4R)-6-[(5-fluoranyl-2-nitro-phenoxy)methyl]-2-oxidanylidene-4-thiophen-2-yl-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: ethyl (4R)-6-[(5-fluoranyl-2-nitro-phenoxy)methyl]-2-oxidanylidene-4-thiophen-2-yl-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl (4R)-6-[(5-fluoro-2-nitro-phenoxy)methyl]-2-oxo-4-(2-thienyl)-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: (4R)-6-[(5-fluoro-2-nitrophenoxy)methyl]-2-oxo-4-thiophen-2-yl-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl (4R)-6-[(5-fluoro-2-nitrophenoxy)methyl]-2-oxo-4-thiophen-2-yl-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: (4R)-6-[(5-fluoro-2-nitro-phenoxy)methyl]-2-keto-4-(2-thienyl)-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C18H16FN3O6S MolecularWeight: 421.399543

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=O)NC1C2=CC=CS2)COC3=C(C=CC(=C3)F)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=C(NC(=O)N[C@H]1C2=CC=CS2)COC3=C(C=CC(=C3)F)[N+](=O)[O-]

InChI

InChI=1S/C18H16FN3O6S/c1-2-27-17(23)15-11(20-18(24)21-16(15)14-4-3-7-29-14)9-28-13-8-10(19)5-6-12(13)22(25)26/h3-8,16H,2,9H2,1H3,(H2,20,21,24)/t16-/m0/s1