methyl (4S)-5-(furan-2-ylcarbonyl)-4-phenyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-6-carboxylate

Systemtic Name: methyl (4S)-5-(furan-2-ylcarbonyl)-4-phenyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-6-carboxylate Openeye Name: methyl (4S)-5-(furan-2-carbonyl)-4-phenyl-2-thioxo-3,4-dihydro-1H-pyrimidine-6-carboxylate CAS Name: (4S)-5-[2-furanyl(oxo)methyl]-4-phenyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-6-carboxylic acid methyl ester IUPAC Name: methyl (4S)-5-(furan-2-carbonyl)-4-phenyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-6-carboxylate Traditional Name: (4S)-5-(2-furoyl)-4-phenyl-2-thioxo-3,4-dihydro-1H-pyrimidine-6-carboxylic acid methyl ester Formula: C17H14N2O4S MolecularWeight: 342.36906

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C(NC(=S)N1)C2=CC=CC=C2)C(=O)C3=CC=CO3

Isomeric SMILES

COC(=O)C1=C([C@@H](NC(=S)N1)C2=CC=CC=C2)C(=O)C3=CC=CO3

InChI

InChI=1S/C17H14N2O4S/c1-22-16(21)14-12(15(20)11-8-5-9-23-11)13(18-17(24)19-14)10-6-3-2-4-7-10/h2-9,13H,1H3,(H2,18,19,24)/t13-/m0/s1