2-[(4-methylphenyl)-phenylazanyl-methyl]sulfanylethanoic acid

Systemtic Name: 2-[(4-methylphenyl)-phenylazanyl-methyl]sulfanylethanoic acid Openeye Name: 2-[anilino(p-tolyl)methyl]sulfanylacetic acid CAS Name: 2-[[anilino-(4-methylphenyl)methyl]thio]acetic acid IUPAC Name: 2-[anilino-(4-methylphenyl)methyl]sulfanylacetic acid Traditional Name: 2-[[anilino(p-tolyl)methyl]thio]acetic acid Formula: C16H17NO2S MolecularWeight: 287.37668

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(NC2=CC=CC=C2)SCC(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)C(NC2=CC=CC=C2)SCC(=O)O

InChI

InChI=1S/C16H17NO2S/c1-12-7-9-13(10-8-12)16(20-11-15(18)19)17-14-5-3-2-4-6-14/h2-10,16-17H,11H2,1H3,(H,18,19)