diethyl-[2-[(6R)-6-(3-fluorophenyl)-5-methoxycarbonyl-4-methyl-2-sulfanylidene-1,6-dihydropyrimidin-3-yl]ethyl]azanium

Systemtic Name: diethyl-[2-[(6R)-6-(3-fluorophenyl)-5-methoxycarbonyl-4-methyl-2-sulfanylidene-1,6-dihydropyrimidin-3-yl]ethyl]azanium Openeye Name: diethyl-[2-[(6R)-6-(3-fluorophenyl)-5-methoxycarbonyl-4-methyl-2-thioxo-1,6-dihydropyrimidin-3-yl]ethyl]ammonium CAS Name: diethyl-[2-[(6R)-6-(3-fluorophenyl)-5-methoxycarbonyl-4-methyl-2-sulfanylidene-1,6-dihydropyrimidin-3-yl]ethyl]ammonium IUPAC Name: diethyl-[2-[(6R)-6-(3-fluorophenyl)-5-methoxycarbonyl-4-methyl-2-sulfanylidene-1,6-dihydropyrimidin-3-yl]ethyl]azanium Traditional Name: 2-[(6R)-5-carbomethoxy-6-(3-fluorophenyl)-4-methyl-2-thioxo-1,6-dihydropyrimidin-3-yl]ethyl-diethyl-ammonium Formula: C19H27FN3O2S+ MolecularWeight: 380.499983

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCN1C(=C(C(NC1=S)C2=CC(=CC=C2)F)C(=O)OC)C

Isomeric SMILES

CC[NH+](CC)CCN1C(=C([C@H](NC1=S)C2=CC(=CC=C2)F)C(=O)OC)C

InChI

InChI=1S/C19H26FN3O2S/c1-5-22(6-2)10-11-23-13(3)16(18(24)25-4)17(21-19(23)26)14-8-7-9-15(20)12-14/h7-9,12,17H,5-6,10-11H2,1-4H3,(H,21,26)/p+1/t17-/m1/s1