4-[(E)-2-(2-fluorophenyl)ethenyl]-6,6-dimethyl-1,5-dihydropyrimidin-3-ium-2-thione

Systemtic Name: 4-[(E)-2-(2-fluorophenyl)ethenyl]-6,6-dimethyl-1,5-dihydropyrimidin-3-ium-2-thione Openeye Name: 4-[(E)-2-(2-fluorophenyl)vinyl]-6,6-dimethyl-1,5-dihydropyrimidin-3-ium-2-thione CAS Name: 4-[(E)-2-(2-fluorophenyl)ethenyl]-6,6-dimethyl-1,5-dihydropyrimidin-3-ium-2-thione IUPAC Name: 4-[(E)-2-(2-fluorophenyl)ethenyl]-6,6-dimethyl-1,5-dihydropyrimidin-3-ium-2-thione Traditional Name: 4-[(E)-2-(2-fluorophenyl)vinyl]-6,6-dimethyl-1,5-dihydropyrimidin-3-ium-2-thione Formula: C14H16FN2S+ MolecularWeight: 263.353643

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=[NH+]C(=S)N1)C=CC2=CC=CC=C2F)C

Isomeric SMILES

CC1(CC(=[NH+]C(=S)N1)/C=C/C2=CC=CC=C2F)C

InChI

InChI=1S/C14H15FN2S/c1-14(2)9-11(16-13(18)17-14)8-7-10-5-3-4-6-12(10)15/h3-8H,9H2,1-2H3,(H,17,18)/p+1/b8-7+