1-(2,2-diphenylethyl)-3-(6-methylsulfanylquinolin-5-yl)urea

Systemtic Name: 1-(2,2-diphenylethyl)-3-(6-methylsulfanylquinolin-5-yl)urea Openeye Name: 1-(2,2-diphenylethyl)-3-(6-methylsulfanyl-5-quinolyl)urea CAS Name: 1-(2,2-diphenylethyl)-3-[6-(methylthio)-5-quinolinyl]urea IUPAC Name: 1-(2,2-diphenylethyl)-3-(6-methylsulfanylquinolin-5-yl)urea Traditional Name: 1-(2,2-diphenylethyl)-3-[6-(methylthio)-5-quinolyl]urea Formula: C25H23N3OS MolecularWeight: 413.53462

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C2=C(C=C1)N=CC=C2)NC(=O)NCC(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CSC1=C(C2=C(C=C1)N=CC=C2)NC(=O)NCC(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C25H23N3OS/c1-30-23-15-14-22-20(13-8-16-26-22)24(23)28-25(29)27-17-21(18-9-4-2-5-10-18)19-11-6-3-7-12-19/h2-16,21H,17H2,1H3,(H2,27,28,29)