1-(3,4-dimethylphenyl)-3-[4-[(3-methylquinoxalin-2-yl)methylsulfanyl]phenyl]urea

Systemtic Name: 1-(3,4-dimethylphenyl)-3-[4-[(3-methylquinoxalin-2-yl)methylsulfanyl]phenyl]urea Openeye Name: 1-(3,4-dimethylphenyl)-3-[4-[(3-methylquinoxalin-2-yl)methylsulfanyl]phenyl]urea CAS Name: 1-(3,4-dimethylphenyl)-3-[4-[(3-methyl-2-quinoxalinyl)methylthio]phenyl]urea IUPAC Name: 1-(3,4-dimethylphenyl)-3-[4-[(3-methylquinoxalin-2-yl)methylsulfanyl]phenyl]urea Traditional Name: 1-(3,4-dimethylphenyl)-3-[4-[(3-methylquinoxalin-2-yl)methylthio]phenyl]urea Formula: C25H24N4OS MolecularWeight: 428.54926

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)NC2=CC=C(C=C2)SCC3=NC4=CC=CC=C4N=C3C)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)NC2=CC=C(C=C2)SCC3=NC4=CC=CC=C4N=C3C)C

InChI

InChI=1S/C25H24N4OS/c1-16-8-9-20(14-17(16)2)28-25(30)27-19-10-12-21(13-11-19)31-15-24-18(3)26-22-6-4-5-7-23(22)29-24/h4-14H,15H2,1-3H3,(H2,27,28,30)