2-[4-(1-azanylethyl)-2-fluoranyl-phenyl]sulfanyl-1H-pyrimidin-6-one

Systemtic Name: 2-[4-(1-azanylethyl)-2-fluoranyl-phenyl]sulfanyl-1H-pyrimidin-6-one Openeye Name: 2-[4-(1-aminoethyl)-2-fluoro-phenyl]sulfanyl-1H-pyrimidin-6-one CAS Name: 2-[[4-(1-aminoethyl)-2-fluorophenyl]thio]-1H-pyrimidin-6-one IUPAC Name: 2-[4-(1-aminoethyl)-2-fluorophenyl]sulfanyl-1H-pyrimidin-6-one Traditional Name: 2-[[4-(1-aminoethyl)-2-fluoro-phenyl]thio]-1H-pyrimidin-6-one Formula: C12H12FN3OS MolecularWeight: 265.306583

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=C(C=C1)SC2=NC=CC(=O)N2)F)N

Isomeric SMILES

CC(C1=CC(=C(C=C1)SC2=NC=CC(=O)N2)F)N

InChI

InChI=1S/C12H12FN3OS/c1-7(14)8-2-3-10(9(13)6-8)18-12-15-5-4-11(17)16-12/h2-7H,14H2,1H3,(H,15,16,17)