2-azanyl-3-[(4-fluorophenyl)-(2-phenylphenyl)methyl]sulfanyl-propanoic acid

Systemtic Name: 2-azanyl-3-[(4-fluorophenyl)-(2-phenylphenyl)methyl]sulfanyl-propanoic acid Openeye Name: 2-amino-3-[(4-fluorophenyl)-(2-phenylphenyl)methyl]sulfanyl-propanoic acid CAS Name: 2-amino-3-[[(4-fluorophenyl)-(2-phenylphenyl)methyl]thio]propanoic acid IUPAC Name: 2-amino-3-[(4-fluorophenyl)-(2-phenylphenyl)methyl]sulfanylpropanoic acid Traditional Name: 2-amino-3-[[(4-fluorophenyl)-(2-phenylphenyl)methyl]thio]propionic acid Formula: C22H20FNO2S MolecularWeight: 381.463103

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC=CC=C2C(C3=CC=C(C=C3)F)SCC(C(=O)O)N

Isomeric SMILES

C1=CC=C(C=C1)C2=CC=CC=C2C(C3=CC=C(C=C3)F)SCC(C(=O)O)N

InChI

InChI=1S/C22H20FNO2S/c23-17-12-10-16(11-13-17)21(27-14-20(24)22(25)26)19-9-5-4-8-18(19)15-6-2-1-3-7-15/h1-13,20-21H,14,24H2,(H,25,26)