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

Systemtic Name: 2-azanyl-3-[(4-fluorophenyl)-(4-methylphenyl)methyl]sulfanyl-propanoic acid Openeye Name: 2-amino-3-[(4-fluorophenyl)-(p-tolyl)methyl]sulfanyl-propanoic acid CAS Name: 2-amino-3-[[(4-fluorophenyl)-(4-methylphenyl)methyl]thio]propanoic acid IUPAC Name: 2-amino-3-[(4-fluorophenyl)-(4-methylphenyl)methyl]sulfanylpropanoic acid Traditional Name: 2-amino-3-[[(4-fluorophenyl)-(p-tolyl)methyl]thio]propionic acid Formula: C17H18FNO2S MolecularWeight: 319.393723

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(C2=CC=C(C=C2)F)SCC(C(=O)O)N

Isomeric SMILES

CC1=CC=C(C=C1)C(C2=CC=C(C=C2)F)SCC(C(=O)O)N

InChI

InChI=1S/C17H18FNO2S/c1-11-2-4-12(5-3-11)16(22-10-15(19)17(20)21)13-6-8-14(18)9-7-13/h2-9,15-16H,10,19H2,1H3,(H,20,21)