1-[3-bromanyl-4-[(phenylmethyl)amino]phenyl]-2-quinolin-4-ylsulfanyl-ethanone

Systemtic Name: 1-[3-bromanyl-4-[(phenylmethyl)amino]phenyl]-2-quinolin-4-ylsulfanyl-ethanone Openeye Name: 1-[4-(benzylamino)-3-bromo-phenyl]-2-(4-quinolylsulfanyl)ethanone CAS Name: 1-[3-bromo-4-[(phenylmethyl)amino]phenyl]-2-(4-quinolinylthio)ethanone IUPAC Name: 1-[4-(benzylamino)-3-bromophenyl]-2-quinolin-4-ylsulfanylethanone Traditional Name: 1-[4-(benzylamino)-3-bromo-phenyl]-2-(4-quinolylthio)ethanone Formula: C24H19BrN2OS MolecularWeight: 463.38946

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC2=C(C=C(C=C2)C(=O)CSC3=CC=NC4=CC=CC=C43)Br

Isomeric SMILES

C1=CC=C(C=C1)CNC2=C(C=C(C=C2)C(=O)CSC3=CC=NC4=CC=CC=C43)Br

InChI

InChI=1S/C24H19BrN2OS/c25-20-14-18(10-11-22(20)27-15-17-6-2-1-3-7-17)23(28)16-29-24-12-13-26-21-9-5-4-8-19(21)24/h1-14,27H,15-16H2