(4-azanyl-2-ethylsulfanyl-pyrimidin-5-yl)-(4-fluorophenyl)methanone

Systemtic Name: (4-azanyl-2-ethylsulfanyl-pyrimidin-5-yl)-(4-fluorophenyl)methanone Openeye Name: (4-amino-2-ethylsulfanyl-pyrimidin-5-yl)-(4-fluorophenyl)methanone CAS Name: [4-amino-2-(ethylthio)-5-pyrimidinyl]-(4-fluorophenyl)methanone IUPAC Name: (4-amino-2-ethylsulfanylpyrimidin-5-yl)-(4-fluorophenyl)methanone Traditional Name: [4-amino-2-(ethylthio)pyrimidin-5-yl]-(4-fluorophenyl)methanone Formula: C13H12FN3OS MolecularWeight: 277.317283

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NC=C(C(=N1)N)C(=O)C2=CC=C(C=C2)F

Isomeric SMILES

CCSC1=NC=C(C(=N1)N)C(=O)C2=CC=C(C=C2)F

InChI

InChI=1S/C13H12FN3OS/c1-2-19-13-16-7-10(12(15)17-13)11(18)8-3-5-9(14)6-4-8/h3-7H,2H2,1H3,(H2,15,16,17)