8-chloranyl-2-(1H-1,2,4-triazol-5-ylsulfanylmethyl)-1H-quinolin-4-one

Systemtic Name: 8-chloranyl-2-(1H-1,2,4-triazol-5-ylsulfanylmethyl)-1H-quinolin-4-one Openeye Name: 8-chloro-2-(1H-1,2,4-triazol-5-ylsulfanylmethyl)-1H-quinolin-4-one CAS Name: 8-chloro-2-[(1H-1,2,4-triazol-5-ylthio)methyl]-1H-quinolin-4-one IUPAC Name: 8-chloro-2-(1H-1,2,4-triazol-5-ylsulfanylmethyl)-1H-quinolin-4-one Traditional Name: 8-chloro-2-[(1H-1,2,4-triazol-5-ylthio)methyl]-4-quinolone Formula: C12H9ClN4OS MolecularWeight: 292.74406

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)Cl)NC(=CC2=O)CSC3=NC=NN3

Isomeric SMILES

C1=CC2=C(C(=C1)Cl)NC(=CC2=O)CSC3=NC=NN3

InChI

InChI=1S/C12H9ClN4OS/c13-9-3-1-2-8-10(18)4-7(16-11(8)9)5-19-12-14-6-15-17-12/h1-4,6H,5H2,(H,16,18)(H,14,15,17)