2-[4-(pyridin-2-ylcarbothioylamino)phenyl]ethanoic acid

Systemtic Name: 2-[4-(pyridin-2-ylcarbothioylamino)phenyl]ethanoic acid Openeye Name: 2-[4-(pyridine-2-carbothioylamino)phenyl]acetic acid CAS Name: 2-[4-[[2-pyridinyl(sulfanylidene)methyl]amino]phenyl]acetic acid IUPAC Name: 2-[4-(pyridine-2-carbothioylamino)phenyl]acetic acid Traditional Name: 2-[4-(pyridine-2-carbothioylamino)phenyl]acetic acid Formula: C14H12N2O2S MolecularWeight: 272.32228

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)C(=S)NC2=CC=C(C=C2)CC(=O)O

Isomeric SMILES

C1=CC=NC(=C1)C(=S)NC2=CC=C(C=C2)CC(=O)O

InChI

InChI=1S/C14H12N2O2S/c17-13(18)9-10-4-6-11(7-5-10)16-14(19)12-3-1-2-8-15-12/h1-8H,9H2,(H,16,19)(H,17,18)