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

Systemtic Name: 2-azanyl-3-[(3-fluorophenyl)-(4-propylphenyl)methyl]sulfanyl-propanoic acid Openeye Name: 2-amino-3-[(3-fluorophenyl)-(4-propylphenyl)methyl]sulfanyl-propanoic acid CAS Name: 2-amino-3-[[(3-fluorophenyl)-(4-propylphenyl)methyl]thio]propanoic acid IUPAC Name: 2-amino-3-[(3-fluorophenyl)-(4-propylphenyl)methyl]sulfanylpropanoic acid Traditional Name: 2-amino-3-[[(3-fluorophenyl)-(4-propylphenyl)methyl]thio]propionic acid Formula: C19H22FNO2S MolecularWeight: 347.446883

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)C(C2=CC(=CC=C2)F)SCC(C(=O)O)N

Isomeric SMILES

CCCC1=CC=C(C=C1)C(C2=CC(=CC=C2)F)SCC(C(=O)O)N

InChI

InChI=1S/C19H22FNO2S/c1-2-4-13-7-9-14(10-8-13)18(24-12-17(21)19(22)23)15-5-3-6-16(20)11-15/h3,5-11,17-18H,2,4,12,21H2,1H3,(H,22,23)