2-[(4-iodophenyl)methylamino]-3-sulfanyl-propanoic acid

Systemtic Name: 2-[(4-iodophenyl)methylamino]-3-sulfanyl-propanoic acid Openeye Name: 2-[(4-iodophenyl)methylamino]-3-sulfanyl-propanoic acid CAS Name: 2-[(4-iodophenyl)methylamino]-3-mercaptopropanoic acid IUPAC Name: 2-[(4-iodophenyl)methylamino]-3-sulfanylpropanoic acid Traditional Name: 2-[(4-iodobenzyl)amino]-3-mercapto-propionic acid Formula: C10H12INO2S MolecularWeight: 337.17725

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CNC(CS)C(=O)O)I

Isomeric SMILES

C1=CC(=CC=C1CNC(CS)C(=O)O)I

InChI

InChI=1S/C10H12INO2S/c11-8-3-1-7(2-4-8)5-12-9(6-15)10(13)14/h1-4,9,12,15H,5-6H2,(H,13,14)