2-[4-[(4-methylphenyl)methylcarbamothioylamino]phenyl]ethanoic acid

Systemtic Name: 2-[4-[(4-methylphenyl)methylcarbamothioylamino]phenyl]ethanoic acid Openeye Name: 2-[4-(p-tolylmethylcarbamothioylamino)phenyl]acetic acid CAS Name: 2-[4-[[[(4-methylphenyl)methylamino]-sulfanylidenemethyl]amino]phenyl]acetic acid IUPAC Name: 2-[4-[(4-methylphenyl)methylcarbamothioylamino]phenyl]acetic acid Traditional Name: 2-[4-[(4-methylbenzyl)thiocarbamoylamino]phenyl]acetic acid Formula: C17H18N2O2S MolecularWeight: 314.40202

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC(=S)NC2=CC=C(C=C2)CC(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)CNC(=S)NC2=CC=C(C=C2)CC(=O)O

InChI

InChI=1S/C17H18N2O2S/c1-12-2-4-14(5-3-12)11-18-17(22)19-15-8-6-13(7-9-15)10-16(20)21/h2-9H,10-11H2,1H3,(H,20,21)(H2,18,19,22)