2-[4-[2-(4-methylphenyl)ethanoylamino]phenyl]sulfanylethanoic acid

Systemtic Name: 2-[4-[2-(4-methylphenyl)ethanoylamino]phenyl]sulfanylethanoic acid Openeye Name: 2-[4-[[2-(p-tolyl)acetyl]amino]phenyl]sulfanylacetic acid CAS Name: 2-[[4-[[2-(4-methylphenyl)-1-oxoethyl]amino]phenyl]thio]acetic acid IUPAC Name: 2-[4-[[2-(4-methylphenyl)acetyl]amino]phenyl]sulfanylacetic acid Traditional Name: 2-[[4-[[2-(p-tolyl)acetyl]amino]phenyl]thio]acetic acid Formula: C17H17NO3S MolecularWeight: 315.38678

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H17NO3S/c1-12-2-4-13(5-3-12)10-16(19)18-14-6-8-15(9-7-14)22-11-17(20)21/h2-9H,10-11H2,1H3,(H,18,19)(H,20,21)