ethyl (4R)-4-(furan-2-yl)-6-(naphthalen-2-ylsulfanylmethyl)-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: ethyl (4R)-4-(furan-2-yl)-6-(naphthalen-2-ylsulfanylmethyl)-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl (4R)-4-(2-furyl)-6-(2-naphthylsulfanylmethyl)-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: (4R)-4-(2-furanyl)-6-[(2-naphthalenylthio)methyl]-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl (4R)-4-(furan-2-yl)-6-(naphthalen-2-ylsulfanylmethyl)-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: (4R)-4-(2-furyl)-2-keto-6-[(2-naphthylthio)methyl]-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C22H20N2O4S MolecularWeight: 408.4702

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=O)NC1C2=CC=CO2)CSC3=CC4=CC=CC=C4C=C3

Isomeric SMILES

CCOC(=O)C1=C(NC(=O)N[C@H]1C2=CC=CO2)CSC3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C22H20N2O4S/c1-2-27-21(25)19-17(23-22(26)24-20(19)18-8-5-11-28-18)13-29-16-10-9-14-6-3-4-7-15(14)12-16/h3-12,20H,2,13H2,1H3,(H2,23,24,26)/t20-/m0/s1