3-(phthalazin-1-ylsulfanylmethyl)-1H-quinoxalin-2-one

Systemtic Name: 3-(phthalazin-1-ylsulfanylmethyl)-1H-quinoxalin-2-one Openeye Name: 3-(phthalazin-1-ylsulfanylmethyl)-1H-quinoxalin-2-one CAS Name: 3-[(1-phthalazinylthio)methyl]-1H-quinoxalin-2-one IUPAC Name: 3-(phthalazin-1-ylsulfanylmethyl)-1H-quinoxalin-2-one Traditional Name: 3-[(phthalazin-1-ylthio)methyl]-1H-quinoxalin-2-one Formula: C17H12N4OS MolecularWeight: 320.36838

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=NN=C2SCC3=NC4=CC=CC=C4NC3=O

Isomeric SMILES

C1=CC=C2C(=C1)C=NN=C2SCC3=NC4=CC=CC=C4NC3=O

InChI

InChI=1S/C17H12N4OS/c22-16-15(19-13-7-3-4-8-14(13)20-16)10-23-17-12-6-2-1-5-11(12)9-18-21-17/h1-9H,10H2,(H,20,22)