2-azanyl-3-(4-phenylsulfanylphenyl)sulfonyl-propanoic acid

Systemtic Name: 2-azanyl-3-(4-phenylsulfanylphenyl)sulfonyl-propanoic acid Openeye Name: 2-amino-3-(4-phenylsulfanylphenyl)sulfonyl-propanoic acid CAS Name: 2-amino-3-[4-(phenylthio)phenyl]sulfonylpropanoic acid IUPAC Name: 2-amino-3-(4-phenylsulfanylphenyl)sulfonylpropanoic acid Traditional Name: 2-amino-3-[4-(phenylthio)phenyl]sulfonyl-propionic acid Formula: C15H15NO4S2 MolecularWeight: 337.4139

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SC2=CC=C(C=C2)S(=O)(=O)CC(C(=O)O)N

Isomeric SMILES

C1=CC=C(C=C1)SC2=CC=C(C=C2)S(=O)(=O)CC(C(=O)O)N

InChI

InChI=1S/C15H15NO4S2/c16-14(15(17)18)10-22(19,20)13-8-6-12(7-9-13)21-11-4-2-1-3-5-11/h1-9,14H,10,16H2,(H,17,18)