4-(1-azanyl-4-phenyl-imidazol-2-yl)sulfanyl-1-(4-fluorophenyl)butan-1-one

Systemtic Name: 4-(1-azanyl-4-phenyl-imidazol-2-yl)sulfanyl-1-(4-fluorophenyl)butan-1-one Openeye Name: 4-(1-amino-4-phenyl-imidazol-2-yl)sulfanyl-1-(4-fluorophenyl)butan-1-one CAS Name: 4-[(1-amino-4-phenyl-2-imidazolyl)thio]-1-(4-fluorophenyl)-1-butanone IUPAC Name: 4-(1-amino-4-phenylimidazol-2-yl)sulfanyl-1-(4-fluorophenyl)butan-1-one Traditional Name: 4-[(1-amino-4-phenyl-imidazol-2-yl)thio]-1-(4-fluorophenyl)butan-1-one Formula: C19H18FN3OS MolecularWeight: 355.429123

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CN(C(=N2)SCCCC(=O)C3=CC=C(C=C3)F)N

Isomeric SMILES

C1=CC=C(C=C1)C2=CN(C(=N2)SCCCC(=O)C3=CC=C(C=C3)F)N

InChI

InChI=1S/C19H18FN3OS/c20-16-10-8-15(9-11-16)18(24)7-4-12-25-19-22-17(13-23(19)21)14-5-2-1-3-6-14/h1-3,5-6,8-11,13H,4,7,12,21H2