4-[3-(phenylmethylsulfanyl)propanoyl]-1,3-dihydroquinoxalin-2-one

Systemtic Name: 4-[3-(phenylmethylsulfanyl)propanoyl]-1,3-dihydroquinoxalin-2-one Openeye Name: 4-(3-benzylsulfanylpropanoyl)-1,3-dihydroquinoxalin-2-one CAS Name: 4-[1-oxo-3-(phenylmethylthio)propyl]-1,3-dihydroquinoxalin-2-one IUPAC Name: 4-(3-benzylsulfanylpropanoyl)-1,3-dihydroquinoxalin-2-one Traditional Name: 4-[3-(benzylthio)propanoyl]-1,3-dihydroquinoxalin-2-one Formula: C18H18N2O2S MolecularWeight: 326.41272

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)NC2=CC=CC=C2N1C(=O)CCSCC3=CC=CC=C3

Isomeric SMILES

C1C(=O)NC2=CC=CC=C2N1C(=O)CCSCC3=CC=CC=C3

InChI

InChI=1S/C18H18N2O2S/c21-17-12-20(16-9-5-4-8-15(16)19-17)18(22)10-11-23-13-14-6-2-1-3-7-14/h1-9H,10-13H2,(H,19,21)