2-azanyl-2-(4-methylphenyl)ethanethioic S-acid

Systemtic Name: 2-azanyl-2-(4-methylphenyl)ethanethioic S-acid Openeye Name: 2-amino-2-(p-tolyl)ethanethioic S-acid CAS Name: 2-amino-2-(4-methylphenyl)ethanethioic S-acid IUPAC Name: 2-amino-2-(4-methylphenyl)ethanethioic S-acid Traditional Name: 2-amino-2-(p-tolyl)thioacetic acid Formula: C9H11NOS MolecularWeight: 181.25474

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(C(=O)S)N

Isomeric SMILES

CC1=CC=C(C=C1)C(C(=O)S)N

InChI

InChI=1S/C9H11NOS/c1-6-2-4-7(5-3-6)8(10)9(11)12/h2-5,8H,10H2,1H3,(H,11,12)