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

Systemtic Name: 2-[2-(1-azanylethyl)-4-fluoranyl-phenyl]sulfanyl-6-propyl-1H-pyrimidin-4-one Openeye Name: 2-[2-(1-aminoethyl)-4-fluoro-phenyl]sulfanyl-6-propyl-1H-pyrimidin-4-one CAS Name: 2-[[2-(1-aminoethyl)-4-fluorophenyl]thio]-6-propyl-1H-pyrimidin-4-one IUPAC Name: 2-[2-(1-aminoethyl)-4-fluorophenyl]sulfanyl-6-propyl-1H-pyrimidin-4-one Traditional Name: 2-[[2-(1-aminoethyl)-4-fluoro-phenyl]thio]-6-propyl-1H-pyrimidin-4-one Formula: C15H18FN3OS MolecularWeight: 307.386323

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=O)N=C(N1)SC2=C(C=C(C=C2)F)C(C)N

Isomeric SMILES

CCCC1=CC(=O)N=C(N1)SC2=C(C=C(C=C2)F)C(C)N

InChI

InChI=1S/C15H18FN3OS/c1-3-4-11-8-14(20)19-15(18-11)21-13-6-5-10(16)7-12(13)9(2)17/h5-9H,3-4,17H2,1-2H3,(H,18,19,20)