2-[(5-ethyl-1H-1,2,4-triazol-3-yl)sulfanylmethyl]-8-fluoranyl-1H-quinolin-4-one

Systemtic Name: 2-[(5-ethyl-1H-1,2,4-triazol-3-yl)sulfanylmethyl]-8-fluoranyl-1H-quinolin-4-one Openeye Name: 2-[(5-ethyl-1H-1,2,4-triazol-3-yl)sulfanylmethyl]-8-fluoro-1H-quinolin-4-one CAS Name: 2-[[(5-ethyl-1H-1,2,4-triazol-3-yl)thio]methyl]-8-fluoro-1H-quinolin-4-one IUPAC Name: 2-[(5-ethyl-1H-1,2,4-triazol-3-yl)sulfanylmethyl]-8-fluoro-1H-quinolin-4-one Traditional Name: 2-[[(5-ethyl-1H-1,2,4-triazol-3-yl)thio]methyl]-8-fluoro-4-quinolone Formula: C14H13FN4OS MolecularWeight: 304.342623

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC(=NN1)SCC2=CC(=O)C3=C(N2)C(=CC=C3)F

Isomeric SMILES

CCC1=NC(=NN1)SCC2=CC(=O)C3=C(N2)C(=CC=C3)F

InChI

InChI=1S/C14H13FN4OS/c1-2-12-17-14(19-18-12)21-7-8-6-11(20)9-4-3-5-10(15)13(9)16-8/h3-6H,2,7H2,1H3,(H,16,20)(H,17,18,19)