2-[(2-phenylazanyl-1,3-thiazol-4-yl)methylsulfanyl]ethanoic acid

Systemtic Name: 2-[(2-phenylazanyl-1,3-thiazol-4-yl)methylsulfanyl]ethanoic acid Openeye Name: 2-[(2-anilinothiazol-4-yl)methylsulfanyl]acetic acid CAS Name: 2-[(2-anilino-4-thiazolyl)methylthio]acetic acid IUPAC Name: 2-[(2-anilino-1,3-thiazol-4-yl)methylsulfanyl]acetic acid Traditional Name: 2-[(2-anilinothiazol-4-yl)methylthio]acetic acid Formula: C12H12N2O2S2 MolecularWeight: 280.36588

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC2=NC(=CS2)CSCC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)NC2=NC(=CS2)CSCC(=O)O

InChI

InChI=1S/C12H12N2O2S2/c15-11(16)8-17-6-10-7-18-12(14-10)13-9-4-2-1-3-5-9/h1-5,7H,6,8H2,(H,13,14)(H,15,16)