2-[(5-chloranyl-1,3-benzothiazol-2-yl)sulfanyl]-2-pyridin-4-yl-ethanoic acid

Systemtic Name: 2-[(5-chloranyl-1,3-benzothiazol-2-yl)sulfanyl]-2-pyridin-4-yl-ethanoic acid Openeye Name: 2-[(5-chloro-1,3-benzothiazol-2-yl)sulfanyl]-2-(4-pyridyl)acetic acid CAS Name: 2-[(5-chloro-1,3-benzothiazol-2-yl)thio]-2-pyridin-4-ylacetic acid IUPAC Name: 2-[(5-chloro-1,3-benzothiazol-2-yl)sulfanyl]-2-pyridin-4-ylacetic acid Traditional Name: 2-[(5-chloro-1,3-benzothiazol-2-yl)thio]-2-(4-pyridyl)acetic acid Formula: C14H9ClN2O2S2 MolecularWeight: 336.81646

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1Cl)N=C(S2)SC(C3=CC=NC=C3)C(=O)O

Isomeric SMILES

C1=CC2=C(C=C1Cl)N=C(S2)SC(C3=CC=NC=C3)C(=O)O

InChI

InChI=1S/C14H9ClN2O2S2/c15-9-1-2-11-10(7-9)17-14(20-11)21-12(13(18)19)8-3-5-16-6-4-8/h1-7,12H,(H,18,19)