2-[(2-fluorophenyl)methylsulfanyl]-5-[2-(furan-2-ylmethylamino)-2-oxidanylidene-ethyl]-6-methyl-pyrimidin-4-olate

Systemtic Name: 2-[(2-fluorophenyl)methylsulfanyl]-5-[2-(furan-2-ylmethylamino)-2-oxidanylidene-ethyl]-6-methyl-pyrimidin-4-olate Openeye Name: 2-[(2-fluorophenyl)methylsulfanyl]-5-[2-(2-furylmethylamino)-2-oxo-ethyl]-6-methyl-pyrimidin-4-olate CAS Name: 2-[(2-fluorophenyl)methylthio]-5-[2-(2-furanylmethylamino)-2-oxoethyl]-6-methyl-4-pyrimidinolate IUPAC Name: 2-[(2-fluorophenyl)methylsulfanyl]-5-[2-(furan-2-ylmethylamino)-2-oxoethyl]-6-methylpyrimidin-4-olate Traditional Name: 2-[(2-fluorobenzyl)thio]-5-[2-(2-furfurylamino)-2-keto-ethyl]-6-methyl-pyrimidin-4-olate Formula: C19H17FN3O3S- MolecularWeight: 386.419983

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)SCC2=CC=CC=C2F)[O-])CC(=O)NCC3=CC=CO3

Isomeric SMILES

CC1=C(C(=NC(=N1)SCC2=CC=CC=C2F)[O-])CC(=O)NCC3=CC=CO3

InChI

InChI=1S/C19H18FN3O3S/c1-12-15(9-17(24)21-10-14-6-4-8-26-14)18(25)23-19(22-12)27-11-13-5-2-3-7-16(13)20/h2-8H,9-11H2,1H3,(H,21,24)(H,22,23,25)/p-1