1-(3-methylphenyl)-3-[2-[(3-methylquinoxalin-2-yl)methylsulfanyl]phenyl]urea

Systemtic Name: 1-(3-methylphenyl)-3-[2-[(3-methylquinoxalin-2-yl)methylsulfanyl]phenyl]urea Openeye Name: 1-[2-[(3-methylquinoxalin-2-yl)methylsulfanyl]phenyl]-3-(m-tolyl)urea CAS Name: 1-(3-methylphenyl)-3-[2-[(3-methyl-2-quinoxalinyl)methylthio]phenyl]urea IUPAC Name: 1-(3-methylphenyl)-3-[2-[(3-methylquinoxalin-2-yl)methylsulfanyl]phenyl]urea Traditional Name: 1-[2-[(3-methylquinoxalin-2-yl)methylthio]phenyl]-3-(m-tolyl)urea Formula: C24H22N4OS MolecularWeight: 414.52268

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)NC2=CC=CC=C2SCC3=NC4=CC=CC=C4N=C3C

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)NC2=CC=CC=C2SCC3=NC4=CC=CC=C4N=C3C

InChI

InChI=1S/C24H22N4OS/c1-16-8-7-9-18(14-16)26-24(29)28-21-12-5-6-13-23(21)30-15-22-17(2)25-19-10-3-4-11-20(19)27-22/h3-14H,15H2,1-2H3,(H2,26,28,29)