2-(aminomethyl)-3-phenyl-propanethioic S-acid

Systemtic Name: 2-(aminomethyl)-3-phenyl-propanethioic S-acid Openeye Name: 2-(aminomethyl)-3-phenyl-propanethioic S-acid CAS Name: 2-(aminomethyl)-3-phenylpropanethioic S-acid IUPAC Name: 2-(aminomethyl)-3-phenylpropanethioic S-acid Traditional Name: 2-(aminomethyl)-3-phenyl-thiopropionic acid Formula: C10H13NOS MolecularWeight: 195.28132

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(CN)C(=O)S

Isomeric SMILES

C1=CC=C(C=C1)CC(CN)C(=O)S

InChI

InChI=1S/C10H13NOS/c11-7-9(10(12)13)6-8-4-2-1-3-5-8/h1-5,9H,6-7,11H2,(H,12,13)