2-methoxyethyl (6R)-6-[3,4-bis(fluoranyl)phenyl]-4-methyl-3-propyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylate

Systemtic Name: 2-methoxyethyl (6R)-6-[3,4-bis(fluoranyl)phenyl]-4-methyl-3-propyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylate Openeye Name: 2-methoxyethyl (6R)-6-(3,4-difluorophenyl)-4-methyl-3-propyl-2-thioxo-1,6-dihydropyrimidine-5-carboxylate CAS Name: (6R)-6-(3,4-difluorophenyl)-4-methyl-3-propyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylic acid 2-methoxyethyl ester IUPAC Name: 2-methoxyethyl (6R)-6-(3,4-difluorophenyl)-4-methyl-3-propyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylate Traditional Name: (6R)-6-(3,4-difluorophenyl)-4-methyl-3-propyl-2-thioxo-1,6-dihydropyrimidine-5-carboxylic acid 2-methoxyethyl ester Formula: C18H22F2N2O3S MolecularWeight: 384.440686

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=C(C(NC1=S)C2=CC(=C(C=C2)F)F)C(=O)OCCOC)C

Isomeric SMILES

CCCN1C(=C([C@H](NC1=S)C2=CC(=C(C=C2)F)F)C(=O)OCCOC)C

InChI

InChI=1S/C18H22F2N2O3S/c1-4-7-22-11(2)15(17(23)25-9-8-24-3)16(21-18(22)26)12-5-6-13(19)14(20)10-12/h5-6,10,16H,4,7-9H2,1-3H3,(H,21,26)/t16-/m1/s1