3-(furan-2-yl)propyl 4-(fluoranylmethyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: 3-(furan-2-yl)propyl 4-(fluoranylmethyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: 3-(2-furyl)propyl 4-(fluoromethyl)-6-methyl-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 4-(fluoromethyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylic acid 3-(2-furanyl)propyl ester IUPAC Name: 3-(furan-2-yl)propyl 4-(fluoromethyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 4-(fluoromethyl)-6-methyl-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid 3-(2-furyl)propyl ester Formula: C14H17FN2O3S MolecularWeight: 312.359783

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(NC(=S)N1)CF)C(=O)OCCCC2=CC=CO2

Isomeric SMILES

CC1=C(C(NC(=S)N1)CF)C(=O)OCCCC2=CC=CO2

InChI

InChI=1S/C14H17FN2O3S/c1-9-12(11(8-15)17-14(21)16-9)13(18)20-7-3-5-10-4-2-6-19-10/h2,4,6,11H,3,5,7-8H2,1H3,(H2,16,17,21)