1-[(4-chloranyl-2-fluoranyl-phenyl)methyl-(phenylmethyl)amino]-2-methyl-3-(sulfinatoamino)benzene

Systemtic Name: 1-[(4-chloranyl-2-fluoranyl-phenyl)methyl-(phenylmethyl)amino]-2-methyl-3-(sulfinatoamino)benzene Openeye Name: 1-[benzyl-[(4-chloro-2-fluoro-phenyl)methyl]amino]-2-methyl-3-(sulfinatoamino)benzene CAS Name: 1-[(4-chloro-2-fluorophenyl)methyl-(phenylmethyl)amino]-2-methyl-3-(sulfinatoamino)benzene IUPAC Name: 1-[benzyl-[(4-chloro-2-fluorophenyl)methyl]amino]-2-methyl-3-(sulfinatoamino)benzene Traditional Name: 1-[benzyl-(4-chloro-2-fluoro-benzyl)amino]-2-methyl-3-(sulfinatoamino)benzene Formula: C21H19ClFN2O2S- MolecularWeight: 417.904163

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1N(CC2=CC=CC=C2)CC3=C(C=C(C=C3)Cl)F)NS(=O)[O-]

Isomeric SMILES

CC1=C(C=CC=C1N(CC2=CC=CC=C2)CC3=C(C=C(C=C3)Cl)F)NS(=O)[O-]

InChI

InChI=1S/C21H20ClFN2O2S/c1-15-20(24-28(26)27)8-5-9-21(15)25(13-16-6-3-2-4-7-16)14-17-10-11-18(22)12-19(17)23/h2-12,24H,13-14H2,1H3,(H,26,27)/p-1